2-amino-N-(2-benzoyl-4-chlorophenyl)-2-fluoroacetamide

C15H12ClFN2O2 — CID 23332701

IUPAC2-amino-N-(2-benzoyl-4-chlorophenyl)-2-fluoroacetamide
SMILESNC(F)C(=O)Nc1ccc(Cl)cc1C(=O)c1ccccc1
InChIInChI=1S/C15H12ClFN2O2/c16-10-6-7-12(19-15(21)14(17)18)11(8-10)13(20)9-4-2-1-3-5-9/h1-8,14H,18H2,(H,19,21)
InChIKeyIHSNVHKPCNBSPW-UHFFFAOYSA-N
MW306.72 g/mol
LogP2.76
Rot. Bonds4

About 2-amino-N-(2-benzoyl-4-chlorophenyl)-2-fluoroacetamide

2-amino-N-(2-benzoyl-4-chlorophenyl)-2-fluoroacetamide (PubChem CID 23332701) has the molecular formula C15H12ClFN2O2 and a molecular weight of 306.72 g/mol. Its IUPAC name is 2-amino-N-(2-benzoyl-4-chlorophenyl)-2-fluoroacetamide.

Molecular Properties

Compound Name2-amino-N-(2-benzoyl-4-chlorophenyl)-2-fluoroacetamide
PubChem CID23332701
Molecular FormulaC15H12ClFN2O2
Molecular Weight306.72 g/mol
Exact Mass306.06
IUPAC Name2-amino-N-(2-benzoyl-4-chlorophenyl)-2-fluoroacetamide
SMILESNC(F)C(=O)Nc1ccc(Cl)cc1C(=O)c1ccccc1
InChIInChI=1S/C15H12ClFN2O2/c16-10-6-7-12(19-15(21)14(17)18)11(8-10)13(20)9-4-2-1-3-5-9/h1-8,14H,18H2,(H,19,21)
InChIKeyIHSNVHKPCNBSPW-UHFFFAOYSA-N
XLogP2.76
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.72
LogP ≤ 52.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-(2-benzoyl-4-chlorophenyl)-2-chloro-2-(4-fluorophenyl)acetamide
CID 52916008
(2R)-N-(2-benzoyl-4-chlorophenyl)-2-methylpentanamide
CID 879686
N-(2-benzoyl-4-chlorophenyl)-2-iodoacetamide
CID 12500538
N-(2-benzoyl-4-methylphenyl)-2,5-dichlorobenzamide
CID 23879994
N-(2-benzoyl-4-chlorophenyl)-2-[4-chloro-3,5-bis(difluoromethyl)pyrazol-1-yl]propanamide
CID 19535673
[2-(2-benzoyl-4-chloroanilino)-2-oxoethyl] 2-methylpropanoate
CID 7782592
N-(2-benzoyl-4-chlorophenyl)-2-[4-(2-methylpropyl)phenyl]propanamide
CID 11839494
N-(2-benzoyl-4-chlorophenyl)-2-chloro-5-iodobenzamide
CID 2295317
N-(2-benzoyl-4-chlorophenyl)-2-(4-formylpiperazin-1-yl)-2-phenylacetamide
CID 52916197
N-(2-benzoyl-4-chlorophenyl)-2-(3-methyl-4-propan-2-ylphenoxy)propanamide
CID 53266932
2-amino-N-[2-(2-benzoyl-4-chloroanilino)acetyl]propanamide
CID 21152776
[5-chloro-2-(cyclopropylamino)phenyl]-phenylmethanone
CID 14598884

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(2-benzoyl-4-chlorophenyl)-2-fluoroacetamide?
The IUPAC name of 2-amino-N-(2-benzoyl-4-chlorophenyl)-2-fluoroacetamide (CID 23332701) is 2-amino-N-(2-benzoyl-4-chlorophenyl)-2-fluoroacetamide.
What is the SMILES notation for 2-amino-N-(2-benzoyl-4-chlorophenyl)-2-fluoroacetamide?
The canonical SMILES for 2-amino-N-(2-benzoyl-4-chlorophenyl)-2-fluoroacetamide is NC(F)C(=O)Nc1ccc(Cl)cc1C(=O)c1ccccc1.
What is the InChIKey of 2-amino-N-(2-benzoyl-4-chlorophenyl)-2-fluoroacetamide?
The InChIKey is IHSNVHKPCNBSPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12ClFN2O2/c16-10-6-7-12(19-15(21)14(17)18)11(8-10)13(20)9-4-2-1-3-5-9/h1-8,14H,18H2,(H,19,21).
What are the key properties of 2-amino-N-(2-benzoyl-4-chlorophenyl)-2-fluoroacetamide?
2-amino-N-(2-benzoyl-4-chlorophenyl)-2-fluoroacetamide has a molecular weight of 306.72 g/mol, XLogP of 2.76, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(2-benzoyl-4-chlorophenyl)-2-fluoroacetamide is sourced from PubChem (CID 23332701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).