[4-(2-aminoanilino)phenyl]-(2-chlorophenyl)methanone

C19H15ClN2O — CID 18358121

IUPAC[4-(2-aminoanilino)phenyl]-(2-chlorophenyl)methanone
SMILESNc1ccccc1Nc1ccc(C(=O)c2ccccc2Cl)cc1
InChIInChI=1S/C19H15ClN2O/c20-16-6-2-1-5-15(16)19(23)13-9-11-14(12-10-13)22-18-8-4-3-7-17(18)21/h1-12,22H,21H2
InChIKeyFCHVFFKUWLDQRG-UHFFFAOYSA-N
MW322.80 g/mol
LogP4.90
Rot. Bonds4

About [4-(2-aminoanilino)phenyl]-(2-chlorophenyl)methanone

[4-(2-aminoanilino)phenyl]-(2-chlorophenyl)methanone (PubChem CID 18358121) has the molecular formula C19H15ClN2O and a molecular weight of 322.80 g/mol. Its IUPAC name is [4-(2-aminoanilino)phenyl]-(2-chlorophenyl)methanone.

Molecular Properties

Compound Name[4-(2-aminoanilino)phenyl]-(2-chlorophenyl)methanone
PubChem CID18358121
Molecular FormulaC19H15ClN2O
Molecular Weight322.80 g/mol
Exact Mass322.09
IUPAC Name[4-(2-aminoanilino)phenyl]-(2-chlorophenyl)methanone
SMILESNc1ccccc1Nc1ccc(C(=O)c2ccccc2Cl)cc1
InChIInChI=1S/C19H15ClN2O/c20-16-6-2-1-5-15(16)19(23)13-9-11-14(12-10-13)22-18-8-4-3-7-17(18)21/h1-12,22H,21H2
InChIKeyFCHVFFKUWLDQRG-UHFFFAOYSA-N
XLogP4.90
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.80
LogP ≤ 54.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

[4-(2-aminoanilino)phenyl]-(2-methylphenyl)methanone
CID 11324104
[2-(2-aminoanilino)phenyl]-phenylmethanone
CID 134442621
(2-chlorophenyl)-[4-(2-nitroanilino)phenyl]methanone
CID 18358103
1-[4-(2-aminoanilino)phenyl]ethanone
CID 82287828
methyl 4-(2-aminoanilino)benzoate
CID 68667054
[4-(2-aminoanilino)-2-chlorophenyl]-[2-(trifluoromethyl)phenyl]methanone
CID 15895830
N-(2-aminophenyl)-2-chlorobenzamide
CID 684680
N-[4-(2-chlorobenzoyl)phenyl]methanesulfonamide
CID 43339036
(2-chlorophenyl)-phenylmethanone;diphenylmethanone
CID 157388336
N-[[4-(2-aminoanilino)phenyl]-phenylmethylidene]hydroxylamine
CID 86204337
4-(2-chlorobenzoyl)benzaldehyde
CID 82118162
(2-aminophenyl)-phenylmethanone
CID 158207972

Frequently Asked Questions

What is the IUPAC name of [4-(2-aminoanilino)phenyl]-(2-chlorophenyl)methanone?
The IUPAC name of [4-(2-aminoanilino)phenyl]-(2-chlorophenyl)methanone (CID 18358121) is [4-(2-aminoanilino)phenyl]-(2-chlorophenyl)methanone.
What is the SMILES notation for [4-(2-aminoanilino)phenyl]-(2-chlorophenyl)methanone?
The canonical SMILES for [4-(2-aminoanilino)phenyl]-(2-chlorophenyl)methanone is Nc1ccccc1Nc1ccc(C(=O)c2ccccc2Cl)cc1.
What is the InChIKey of [4-(2-aminoanilino)phenyl]-(2-chlorophenyl)methanone?
The InChIKey is FCHVFFKUWLDQRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15ClN2O/c20-16-6-2-1-5-15(16)19(23)13-9-11-14(12-10-13)22-18-8-4-3-7-17(18)21/h1-12,22H,21H2.
What are the key properties of [4-(2-aminoanilino)phenyl]-(2-chlorophenyl)methanone?
[4-(2-aminoanilino)phenyl]-(2-chlorophenyl)methanone has a molecular weight of 322.80 g/mol, XLogP of 4.90, 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]-(2-chlorophenyl)methanone is sourced from PubChem (CID 18358121), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).