N-(2-benzoyl-4-chlorophenyl)-N-chloroacetamide

C15H11Cl2NO2 — CID 139392236

IUPACN-(2-benzoyl-4-chlorophenyl)-N-chloroacetamide
SMILESCC(=O)N(Cl)c1ccc(Cl)cc1C(=O)c1ccccc1
InChIInChI=1S/C15H11Cl2NO2/c1-10(19)18(17)14-8-7-12(16)9-13(14)15(20)11-5-3-2-4-6-11/h2-9H,1H3
InChIKeyUELLMVLBINOMKA-UHFFFAOYSA-N
MW308.16 g/mol
LogP4.08
Rot. Bonds3

About N-(2-benzoyl-4-chlorophenyl)-N-chloroacetamide

N-(2-benzoyl-4-chlorophenyl)-N-chloroacetamide (PubChem CID 139392236) has the molecular formula C15H11Cl2NO2 and a molecular weight of 308.16 g/mol. Its IUPAC name is N-(2-benzoyl-4-chlorophenyl)-N-chloroacetamide.

Molecular Properties

Compound NameN-(2-benzoyl-4-chlorophenyl)-N-chloroacetamide
PubChem CID139392236
Molecular FormulaC15H11Cl2NO2
Molecular Weight308.16 g/mol
Exact Mass307.02
IUPAC NameN-(2-benzoyl-4-chlorophenyl)-N-chloroacetamide
SMILESCC(=O)N(Cl)c1ccc(Cl)cc1C(=O)c1ccccc1
InChIInChI=1S/C15H11Cl2NO2/c1-10(19)18(17)14-8-7-12(16)9-13(14)15(20)11-5-3-2-4-6-11/h2-9H,1H3
InChIKeyUELLMVLBINOMKA-UHFFFAOYSA-N
XLogP4.08
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.16
LogP ≤ 54.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-(2-benzoyl-4-chlorophenyl)-N-bromoacetamide
CID 154157817
(4-chlorophenyl)-phenylmethanone;propan-2-one
CID 175521712
2-amino-N-[2-(2-benzoyl-4-chloro-N-methylanilino)acetyl]acetamide;hydrobromide
CID 70561655
2-amino-N-[2-(2-benzoyl-4-chloro-N-propan-2-ylanilino)acetyl]acetamide
CID 3057617
(3-benzoyl-4-chlorophenyl)-(4-chlorophenyl)methanone
CID 18951954
2-benzoyl-4-chlorobenzenesulfonyl chloride
CID 2756600
[5-chloro-2-[(4-chlorophenyl)diazenyl]phenyl]-phenylmethanone
CID 102337066
[5-chloro-2-(methoxyamino)phenyl]-phenylmethanone
CID 145356956
(4-chlorophenyl)-phenylmethanone dichloride
CID 22505815
1-[2-(4-chlorobenzoyl)phenyl]ethanone
CID 2800946
N-acetyl-N-(2-benzoylphenyl)acetamide
CID 23206661
(2S)-2-amino-N-[2-(2-benzoyl-4-chloro-N-methylanilino)acetyl]-3-phenylpropanamide
CID 3042184

Frequently Asked Questions

What is the IUPAC name of N-(2-benzoyl-4-chlorophenyl)-N-chloroacetamide?
The IUPAC name of N-(2-benzoyl-4-chlorophenyl)-N-chloroacetamide (CID 139392236) is N-(2-benzoyl-4-chlorophenyl)-N-chloroacetamide.
What is the SMILES notation for N-(2-benzoyl-4-chlorophenyl)-N-chloroacetamide?
The canonical SMILES for N-(2-benzoyl-4-chlorophenyl)-N-chloroacetamide is CC(=O)N(Cl)c1ccc(Cl)cc1C(=O)c1ccccc1.
What is the InChIKey of N-(2-benzoyl-4-chlorophenyl)-N-chloroacetamide?
The InChIKey is UELLMVLBINOMKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11Cl2NO2/c1-10(19)18(17)14-8-7-12(16)9-13(14)15(20)11-5-3-2-4-6-11/h2-9H,1H3.
What are the key properties of N-(2-benzoyl-4-chlorophenyl)-N-chloroacetamide?
N-(2-benzoyl-4-chlorophenyl)-N-chloroacetamide has a molecular weight of 308.16 g/mol, XLogP of 4.08, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-benzoyl-4-chlorophenyl)-N-chloroacetamide is sourced from PubChem (CID 139392236), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).