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

C19H16N2O — CID 134442621

IUPAC[2-(2-aminoanilino)phenyl]-phenylmethanone
SMILESNc1ccccc1Nc1ccccc1C(=O)c1ccccc1
InChIInChI=1S/C19H16N2O/c20-16-11-5-7-13-18(16)21-17-12-6-4-10-15(17)19(22)14-8-2-1-3-9-14/h1-13,21H,20H2
InChIKeyNIMROYGMMCZKAZ-UHFFFAOYSA-N
MW288.35 g/mol
LogP4.24
Rot. Bonds4

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

[2-(2-aminoanilino)phenyl]-phenylmethanone (PubChem CID 134442621) has the molecular formula C19H16N2O and a molecular weight of 288.35 g/mol. Its IUPAC name is [2-(2-aminoanilino)phenyl]-phenylmethanone.

Molecular Properties

Compound Name[2-(2-aminoanilino)phenyl]-phenylmethanone
PubChem CID134442621
Molecular FormulaC19H16N2O
Molecular Weight288.35 g/mol
Exact Mass288.13
IUPAC Name[2-(2-aminoanilino)phenyl]-phenylmethanone
SMILESNc1ccccc1Nc1ccccc1C(=O)c1ccccc1
InChIInChI=1S/C19H16N2O/c20-16-11-5-7-13-18(16)21-17-12-6-4-10-15(17)19(22)14-8-2-1-3-9-14/h1-13,21H,20H2
InChIKeyNIMROYGMMCZKAZ-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': 'anthranil_one_A(38)', 'substructure': 'N/A'}, {'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

[4-(2-aminoanilino)phenyl]-(2-chlorophenyl)methanone
CID 18358121
(2-aminophenyl)-phenylmethanone
CID 158207972
[4-(2-aminoanilino)phenyl]-(2-methylphenyl)methanone
CID 11324104
(2-aminophenyl)-phenylmethanone;diphenylmethanone
CID 90112643
[2-[(4-amino-5-methyl-3-pyridinyl)amino]phenyl]-phenylmethanone
CID 54499105
bis(2-anilinophenyl)methanone
CID 141301141
[4-(2-aminoanilino)-3-(dimethylamino)phenyl]-phenylmethanone
CID 174393841
[2-(2-benzoylanilino)-2-oxoethyl] 2-aminobenzoate
CID 5155011
ethyl 2-(2-aminoanilino)benzoate
CID 131846844
[2-(ethylamino)phenyl]-phenylmethanone
CID 3661027
N-(2-benzoylphenyl)-2-oxo-2-phenylacetamide
CID 614189
1-benzoyl-2-(sulfinoamino)benzene
CID 23299444

Frequently Asked Questions

What is the IUPAC name of [2-(2-aminoanilino)phenyl]-phenylmethanone?
The IUPAC name of [2-(2-aminoanilino)phenyl]-phenylmethanone (CID 134442621) is [2-(2-aminoanilino)phenyl]-phenylmethanone.
What is the SMILES notation for [2-(2-aminoanilino)phenyl]-phenylmethanone?
The canonical SMILES for [2-(2-aminoanilino)phenyl]-phenylmethanone is Nc1ccccc1Nc1ccccc1C(=O)c1ccccc1.
What is the InChIKey of [2-(2-aminoanilino)phenyl]-phenylmethanone?
The InChIKey is NIMROYGMMCZKAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16N2O/c20-16-11-5-7-13-18(16)21-17-12-6-4-10-15(17)19(22)14-8-2-1-3-9-14/h1-13,21H,20H2.
What are the key properties of [2-(2-aminoanilino)phenyl]-phenylmethanone?
[2-(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 [2-(2-aminoanilino)phenyl]-phenylmethanone is sourced from PubChem (CID 134442621), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).