N-(3-acetylphenyl)-2-(4-chloroanilino)acetamide

C16H15ClN2O2 — CID 26506544

IUPACN-(3-acetylphenyl)-2-(4-chloroanilino)acetamide
SMILESCC(=O)c1cccc(NC(=O)CNc2ccc(Cl)cc2)c1
InChIInChI=1S/C16H15ClN2O2/c1-11(20)12-3-2-4-15(9-12)19-16(21)10-18-14-7-5-13(17)6-8-14/h2-9,18H,10H2,1H3,(H,19,21)
InChIKeyLWEHWTQQLAFCPA-UHFFFAOYSA-N
MW302.76 g/mol
LogP3.59
Rot. Bonds5

About N-(3-acetylphenyl)-2-(4-chloroanilino)acetamide

N-(3-acetylphenyl)-2-(4-chloroanilino)acetamide (PubChem CID 26506544) has the molecular formula C16H15ClN2O2 and a molecular weight of 302.76 g/mol. Its IUPAC name is N-(3-acetylphenyl)-2-(4-chloroanilino)acetamide.

Molecular Properties

Compound NameN-(3-acetylphenyl)-2-(4-chloroanilino)acetamide
PubChem CID26506544
Molecular FormulaC16H15ClN2O2
Molecular Weight302.76 g/mol
Exact Mass302.08
IUPAC NameN-(3-acetylphenyl)-2-(4-chloroanilino)acetamide
SMILESCC(=O)c1cccc(NC(=O)CNc2ccc(Cl)cc2)c1
InChIInChI=1S/C16H15ClN2O2/c1-11(20)12-3-2-4-15(9-12)19-16(21)10-18-14-7-5-13(17)6-8-14/h2-9,18H,10H2,1H3,(H,19,21)
InChIKeyLWEHWTQQLAFCPA-UHFFFAOYSA-N
XLogP3.59
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.76
LogP ≤ 53.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3-acetylanilino)-N-(3-chloro-4-fluorophenyl)acetamide
CID 9084520
N-[3-[[2-(4-chloroanilino)acetyl]amino]phenyl]benzamide
CID 54810283
methyl 4-[[2-(3-acetylanilino)-2-oxoethyl]amino]benzoate
CID 26506872
2-[[2-(3-acetylanilino)-2-oxoethyl]amino]-N-(4-chlorophenyl)benzamide
CID 18228642
3-[[2-(4-chloroanilino)acetyl]amino]-N,N-dipropylbenzamide
CID 54810385
2-(3-acetylanilino)-N-(3-fluoro-4-methylphenyl)acetamide
CID 9099428
N-(3-acetylphenyl)-2-[(4-chlorophenyl)methylamino]acetamide
CID 108998163
N-butyl-3-[[2-(4-chloroanilino)acetyl]amino]benzamide
CID 54810309
N-(3-acetylphenyl)-2-(4-phenoxyanilino)acetamide
CID 109009860
2-(4-acetylanilino)-N-(3-chloro-4-fluorophenyl)acetamide
CID 9079945
N-tert-butyl-3-[[2-(4-chloroanilino)-2-oxoethyl]amino]benzamide
CID 54844566
N-(4-acetamidophenyl)-2-(4-chloroanilino)acetamide
CID 2604426

Frequently Asked Questions

What is the IUPAC name of N-(3-acetylphenyl)-2-(4-chloroanilino)acetamide?
The IUPAC name of N-(3-acetylphenyl)-2-(4-chloroanilino)acetamide (CID 26506544) is N-(3-acetylphenyl)-2-(4-chloroanilino)acetamide.
What is the SMILES notation for N-(3-acetylphenyl)-2-(4-chloroanilino)acetamide?
The canonical SMILES for N-(3-acetylphenyl)-2-(4-chloroanilino)acetamide is CC(=O)c1cccc(NC(=O)CNc2ccc(Cl)cc2)c1.
What is the InChIKey of N-(3-acetylphenyl)-2-(4-chloroanilino)acetamide?
The InChIKey is LWEHWTQQLAFCPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15ClN2O2/c1-11(20)12-3-2-4-15(9-12)19-16(21)10-18-14-7-5-13(17)6-8-14/h2-9,18H,10H2,1H3,(H,19,21).
What are the key properties of N-(3-acetylphenyl)-2-(4-chloroanilino)acetamide?
N-(3-acetylphenyl)-2-(4-chloroanilino)acetamide has a molecular weight of 302.76 g/mol, XLogP of 3.59, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-acetylphenyl)-2-(4-chloroanilino)acetamide is sourced from PubChem (CID 26506544), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).