[4-(2-aminoanilino)phenyl]-phenylmethanone

C19H16N2O — CID 11737779

IUPAC[4-(2-aminoanilino)phenyl]-phenylmethanone
SMILESNc1ccccc1Nc1ccc(C(=O)c2ccccc2)cc1
InChIInChI=1S/C19H16N2O/c20-17-8-4-5-9-18(17)21-16-12-10-15(11-13-16)19(22)14-6-2-1-3-7-14/h1-13,21H,20H2
InChIKeyRAWYMBACZSQNDD-UHFFFAOYSA-N
MW288.35 g/mol
LogP4.24
Rot. Bonds4

About [4-(2-aminoanilino)phenyl]-phenylmethanone

[4-(2-aminoanilino)phenyl]-phenylmethanone (PubChem CID 11737779) has the molecular formula C19H16N2O and a molecular weight of 288.35 g/mol. Its IUPAC name is [4-(2-aminoanilino)phenyl]-phenylmethanone.

Molecular Properties

Compound Name[4-(2-aminoanilino)phenyl]-phenylmethanone
PubChem CID11737779
Molecular FormulaC19H16N2O
Molecular Weight288.35 g/mol
Exact Mass288.13
IUPAC Name[4-(2-aminoanilino)phenyl]-phenylmethanone
SMILESNc1ccccc1Nc1ccc(C(=O)c2ccccc2)cc1
InChIInChI=1S/C19H16N2O/c20-17-8-4-5-9-18(17)21-16-12-10-15(11-13-16)19(22)14-6-2-1-3-7-14/h1-13,21H,20H2
InChIKeyRAWYMBACZSQNDD-UHFFFAOYSA-N
XLogP4.24
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.35
LogP ≤ 54.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of [4-(2-aminoanilino)phenyl]-phenylmethanone?
The IUPAC name of [4-(2-aminoanilino)phenyl]-phenylmethanone (CID 11737779) is [4-(2-aminoanilino)phenyl]-phenylmethanone.
What is the SMILES notation for [4-(2-aminoanilino)phenyl]-phenylmethanone?
The canonical SMILES for [4-(2-aminoanilino)phenyl]-phenylmethanone is Nc1ccccc1Nc1ccc(C(=O)c2ccccc2)cc1.
What is the InChIKey of [4-(2-aminoanilino)phenyl]-phenylmethanone?
The InChIKey is RAWYMBACZSQNDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16N2O/c20-17-8-4-5-9-18(17)21-16-12-10-15(11-13-16)19(22)14-6-2-1-3-7-14/h1-13,21H,20H2.
What are the key properties of [4-(2-aminoanilino)phenyl]-phenylmethanone?
[4-(2-aminoanilino)phenyl]-phenylmethanone has a molecular weight of 288.35 g/mol, XLogP of 4.24, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(2-aminoanilino)phenyl]-phenylmethanone is sourced from PubChem (CID 11737779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).