N-[4-(3-acetylanilino)phenyl]benzamide

C21H18N2O2 — CID 112988119

IUPACN-[4-(3-acetylanilino)phenyl]benzamide
SMILESCC(=O)c1cccc(Nc2ccc(NC(=O)c3ccccc3)cc2)c1
InChIInChI=1S/C21H18N2O2/c1-15(24)17-8-5-9-20(14-17)22-18-10-12-19(13-11-18)23-21(25)16-6-3-2-4-7-16/h2-14,22H,1H3,(H,23,25)
InChIKeyAKOAVQGRQCJTLJ-UHFFFAOYSA-N
MW330.39 g/mol
LogP4.89
Rot. Bonds5

About N-[4-(3-acetylanilino)phenyl]benzamide

N-[4-(3-acetylanilino)phenyl]benzamide (PubChem CID 112988119) has the molecular formula C21H18N2O2 and a molecular weight of 330.39 g/mol. Its IUPAC name is N-[4-(3-acetylanilino)phenyl]benzamide.

Molecular Properties

Compound NameN-[4-(3-acetylanilino)phenyl]benzamide
PubChem CID112988119
Molecular FormulaC21H18N2O2
Molecular Weight330.39 g/mol
Exact Mass330.14
IUPAC NameN-[4-(3-acetylanilino)phenyl]benzamide
SMILESCC(=O)c1cccc(Nc2ccc(NC(=O)c3ccccc3)cc2)c1
InChIInChI=1S/C21H18N2O2/c1-15(24)17-8-5-9-20(14-17)22-18-10-12-19(13-11-18)23-21(25)16-6-3-2-4-7-16/h2-14,22H,1H3,(H,23,25)
InChIKeyAKOAVQGRQCJTLJ-UHFFFAOYSA-N
XLogP4.89
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.39
LogP ≤ 54.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[4-(3-acetylanilino)phenyl]-3,4-dimethylbenzamide
CID 112988131
N-[4-(3-acetylanilino)phenyl]-3,4-difluorobenzamide
CID 112988151
N-(4-anilinophenyl)-4-benzamidobenzamide
CID 52560314
N-[4-(3-fluoroanilino)phenyl]benzamide
CID 112988934
N-(3-acetylphenyl)-4-anilinopyridine-2-carboxamide
CID 109218881
N-[4-(3-acetylanilino)phenyl]furan-2-carboxamide
CID 112988117
1-[3-(4-aminoanilino)phenyl]ethanone
CID 82287829
3-(4-acetylanilino)benzoic acid
CID 11184397
5-acetyl-1-N,3-N-diphenylbenzene-1,3-dicarboxamide
CID 144544324
N-(3-acetylphenyl)-4-tert-butylbenzamide
CID 722882
N-[3-[(E)-N-hydroxy-C-methylcarbonimidoyl]phenyl]benzamide
CID 24691047
3,5-dibenzamido-N-phenylbenzamide
CID 17340966

Frequently Asked Questions

What is the IUPAC name of N-[4-(3-acetylanilino)phenyl]benzamide?
The IUPAC name of N-[4-(3-acetylanilino)phenyl]benzamide (CID 112988119) is N-[4-(3-acetylanilino)phenyl]benzamide.
What is the SMILES notation for N-[4-(3-acetylanilino)phenyl]benzamide?
The canonical SMILES for N-[4-(3-acetylanilino)phenyl]benzamide is CC(=O)c1cccc(Nc2ccc(NC(=O)c3ccccc3)cc2)c1.
What is the InChIKey of N-[4-(3-acetylanilino)phenyl]benzamide?
The InChIKey is AKOAVQGRQCJTLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H18N2O2/c1-15(24)17-8-5-9-20(14-17)22-18-10-12-19(13-11-18)23-21(25)16-6-3-2-4-7-16/h2-14,22H,1H3,(H,23,25).
What are the key properties of N-[4-(3-acetylanilino)phenyl]benzamide?
N-[4-(3-acetylanilino)phenyl]benzamide has a molecular weight of 330.39 g/mol, XLogP of 4.89, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(3-acetylanilino)phenyl]benzamide is sourced from PubChem (CID 112988119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).