N-(3-acetyl-4-chlorophenyl)-2-chlorobenzamide

C15H11Cl2NO2 — CID 22888926

IUPACN-(3-acetyl-4-chlorophenyl)-2-chlorobenzamide
SMILESCC(=O)c1cc(NC(=O)c2ccccc2Cl)ccc1Cl
InChIInChI=1S/C15H11Cl2NO2/c1-9(19)12-8-10(6-7-14(12)17)18-15(20)11-4-2-3-5-13(11)16/h2-8H,1H3,(H,18,20)
InChIKeyBPKNUUJIDSAVQW-UHFFFAOYSA-N
MW308.16 g/mol
LogP4.45
Rot. Bonds3

About N-(3-acetyl-4-chlorophenyl)-2-chlorobenzamide

N-(3-acetyl-4-chlorophenyl)-2-chlorobenzamide (PubChem CID 22888926) has the molecular formula C15H11Cl2NO2 and a molecular weight of 308.16 g/mol. Its IUPAC name is N-(3-acetyl-4-chlorophenyl)-2-chlorobenzamide.

Molecular Properties

Compound NameN-(3-acetyl-4-chlorophenyl)-2-chlorobenzamide
PubChem CID22888926
Molecular FormulaC15H11Cl2NO2
Molecular Weight308.16 g/mol
Exact Mass307.02
IUPAC NameN-(3-acetyl-4-chlorophenyl)-2-chlorobenzamide
SMILESCC(=O)c1cc(NC(=O)c2ccccc2Cl)ccc1Cl
InChIInChI=1S/C15H11Cl2NO2/c1-9(19)12-8-10(6-7-14(12)17)18-15(20)11-4-2-3-5-13(11)16/h2-8H,1H3,(H,18,20)
InChIKeyBPKNUUJIDSAVQW-UHFFFAOYSA-N
XLogP4.45
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.16
LogP ≤ 54.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[(3-acetyl-4-chlorophenyl)carbamoyl]benzoic acid
CID 85472718
N-(3-acetamidophenyl)-2-chlorobenzamide
CID 792012
2-chloro-N-(3-chloro-4-hydroxyphenyl)benzamide
CID 5119935
2-chloro-N-(4-sulfanylphenyl)benzamide
CID 27137419
2-chloro-N-[4-[(3,4-dimethylphenyl)carbamoyl]phenyl]benzamide
CID 2990559
N-(3-amino-4-methoxyphenyl)-2-chlorobenzamide
CID 23464385
methyl 2-chloro-5-[(2-iodobenzoyl)amino]benzoate
CID 1312112
N-[3-[acetyl(methyl)amino]phenyl]-2-chlorobenzamide
CID 46761791
N-[6-(3-acetylanilino)-3-pyridinyl]-2-chlorobenzamide
CID 113020334
5-acetamido-2-chloro-N-(3-chloro-4-methylphenyl)benzamide
CID 885622
2-chloro-N-[4-(1-hydroxyethyl)phenyl]benzamide
CID 43508377
2-[(3,4-dichlorophenyl)carbamoyl]benzoate
CID 5106258

Frequently Asked Questions

What is the IUPAC name of N-(3-acetyl-4-chlorophenyl)-2-chlorobenzamide?
The IUPAC name of N-(3-acetyl-4-chlorophenyl)-2-chlorobenzamide (CID 22888926) is N-(3-acetyl-4-chlorophenyl)-2-chlorobenzamide.
What is the SMILES notation for N-(3-acetyl-4-chlorophenyl)-2-chlorobenzamide?
The canonical SMILES for N-(3-acetyl-4-chlorophenyl)-2-chlorobenzamide is CC(=O)c1cc(NC(=O)c2ccccc2Cl)ccc1Cl.
What is the InChIKey of N-(3-acetyl-4-chlorophenyl)-2-chlorobenzamide?
The InChIKey is BPKNUUJIDSAVQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11Cl2NO2/c1-9(19)12-8-10(6-7-14(12)17)18-15(20)11-4-2-3-5-13(11)16/h2-8H,1H3,(H,18,20).
What are the key properties of N-(3-acetyl-4-chlorophenyl)-2-chlorobenzamide?
N-(3-acetyl-4-chlorophenyl)-2-chlorobenzamide has a molecular weight of 308.16 g/mol, XLogP of 4.45, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-acetyl-4-chlorophenyl)-2-chlorobenzamide is sourced from PubChem (CID 22888926), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).