N-isopropyl-N'-phenyl-p-phenylenediamine

Name: N-isopropyl-N'-phenyl-p-phenylenediamine (CAS 101-72-4) – space-filling 3D model – rotation animation, MolGod Viewer
Uploaded: 2026-11-01T12:49:44Z
Duration: 3 s
Channel: MolGod Scientific
Description: N-isopropyl-N'-phenyl-p-phenylenediamine (CAS 101-72-4) – space-filling 3D model – rotation animation, MolGod Viewer

CAS 101-72-4 · C₁₅H₁₈N₂ · MW 226.32 g/mol

Full record: N-isopropyl-N'-phenyl-p-phenylenediamine — Safety Data Sheet →

Model views

ball-and-stick 3D model
skeletal 3D model
space-filling 3D model – rotation animation
2D structure

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ENGRAVEDNORMAL

N-isopropyl-N'-phenyl-p-phenylenediamine (CAS 101-72-4), C15H18N2 - 3D ball-and-stick molecular model, engraved element symbols (C H N), MolGod STL preview

MG_186-837-505-46 · engraved · 430,650 △ · 21 MB · SHA-256 44cf6fa2c826804a

Download 3D model: N-isopropyl-N'-phenyl-p-phenylenediamine, C₁₅H₁₈N₂, CAS 101-72-4 · ENGRAVED (C, H, N) · 21 MB

N-isopropyl-N'-phenyl-p-phenylenediamine (CAS 101-72-4), C15H18N2 - 3D ball-and-stick molecular model, MolGod STL preview

MG_186-837-505-46 · normal · 15,232 △ · 744 KB · SHA-256 4c1cc7e98385461b

Download 3D model: N-isopropyl-N'-phenyl-p-phenylenediamine, C₁₅H₁₈N₂, CAS 101-72-4 · NORMAL · 744 KB

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About N-isopropyl-N'-phenyl-p-phenylenediamine

N-isopropyl-N'-phenyl-p-phenylenediamine is a chemical compound registered under number CAS 101-72-4, with the molecular formula C₁₅H₁₈N₂, and a molar mass of 226.32 g/mol.

The molecule contains 35 atoms connected by 36 chemical bonds. The full systematic IUPAC name of this compound is 1-N-phenyl-4-N-propan-2-ylbenzene-1,4-diamine. The interactive 3D model above lets you view the spatial arrangement of the atoms — you can rotate it with the mouse, zoom with the scroll wheel, and switch between skeletal / Ball & Stick / Space Fill visualization modes.

In terms of physicochemical properties, the partition coefficient logP = 4 (positive value, a lipophilic compound), polar surface area PSA = 24.1 Å², 2 donors and 2 hydrogen bond acceptors. These parameters are key when assessing bioavailability and interaction with biomolecules.

Chemical data for this compound comes from PubChem (NIH NLM NCBI), one of the world's largest chemical databases. All information is updated automatically and enriched with GHS hazard statement translations compliant with the CLP Regulation (EC 1272/2008). The interactive 3D model and the viewer images are protected by copyright (© MolGod.org) — terms of use: molgod.org/copyright/.

Physicochemical properties

Molecular formula	C₁₅H₁₈N₂
Molar mass	226.32 g/mol
IUPAC	1-N-phenyl-4-N-propan-2-ylbenzene-1,4-diamine
SMILES	`CC(C)NC1=CC=C(C=C1)NC2=CC=CC=C2`
InChIKey	`OUBMGJOQLXMSNT-UHFFFAOYSA-N`
logP (XLogP3)	4
PSA	24.1 Å²
HBD / HBA	2 / 2
PubChem CID	CID 7573 ↗

GHS safety

Signal word: Warning

GHS07

GHS09

H302 — Harmful if swallowed

H317 — May cause an allergic skin reaction

H400 — Very toxic to aquatic life

H410 — Very toxic to aquatic life with long lasting effects

Scientific literature

Brak articles naukowych dla CAS 101-72-4 w PubMed / OpenAlex / Semantic Scholar.

Synonyms

101-72-4 · N-Isopropyl-N'-phenyl-p-phenylenediamine · N-isopropyl-N'-phenyl-1,4-phenylenediamine · Cyzone · 4-Isopropylaminodiphenylamine · Nonox ZA · 4-Anilino-N-isopropylaniline · Antioxidant 4010NA · Antigen 3c · Diafen FP · Antioxidant 40NA · Antioxidant IP · Santoflex IP · 4-(ISOPROPYLAMINO)DIPHENYLAMINE · Diaphen FP

Data sources

📊 PubChem CID 7573 — NIH
🔬 NIST WebBook — spectroscopy
💊 ChEMBL — bioactivity

Related molecules

Aniline (CAS 62-53-3) CAS 62-53-3 · C6H7N Shared hazard H317 N-Phenyl-o-phenylenediamine CAS 534-85-0 · C12H12N2 Similar structure · Tanimoto 0.37 (R)-3-Amino-2-phenylpropionic acid CAS 1008-63-5 · C9H11NO2 Shared hazard H317 1-phenylethylamine (CAS 618-36-0) CAS 618-36-0 · C8H11N Similar structure · Tanimoto 0.32 Triphenylphosphine CAS 603-35-0 · C18H15P Shared hazard H317 4-methoxy-2-methyl-N-phenylaniline CAS 41317-15-1 · C14H15NO Similar structure · Tanimoto 0.32

📜 License & provenanceMolGod_License_1

COMPUTED — PubChem3D · 3D conformer computed by PubChem using OMEGA; not an experimental structure.

Model: N-isopropyl-N'-phenyl-p-phenylenediamine · 101-72-4
InChIKey: OUBMGJOQLXMSNT-UHFFFAOYSA-N
License: CC BY-SA 4.0 International
Attribution: MolGod Scientific — N-isopropyl-N'-phenyl-p-phenylenediamine (CAS 101-72-4)
License & provenance record: N-isopropyl-N'-phenyl-p-phenylenediamine (CAS 101-72-4) →
MolGod molecule record: N-isopropyl-N'-phenyl-p-phenylenediamine →
Source data: PubChem CID 7573 ↗
Model information: STL generated by MolGod · MolGod STL Exporter build 48804cd20b0d · generated 2026-10-14
SHA-256 (STL): 4c1cc7e98385461be8436ecfd60ab70da7f5b37d5e3bfc07f475b4cae7451853
MD5 (STL): b78f20882a7a93e8d841256d2abbbffb
MolGod Identification Number: MG_186-837-505-46
Transformation: MolGod Scientific ball-and-stick mesh
Changes: Converted into a triangulated molecular mesh; atomic coordinates and connectivity unchanged.
Wikimedia Commons: STL · PNG

📄 Download 3D model: N-isopropyl-N'-phenyl-p-phenylenediamine, C₁₅H₁₈N₂, CAS 101-72-4 · NORMAL · 744 KB 📄 Download 3D model: N-isopropyl-N'-phenyl-p-phenylenediamine, C₁₅H₁₈N₂, CAS 101-72-4 · ENGRAVED (C, H, N) · 21 MB

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