N-(3-acetamidophenyl)-3-chloro-4-fluorobenzamide

C15H12ClFN2O2 — CID 110764762

IUPACN-(3-acetamidophenyl)-3-chloro-4-fluorobenzamide
SMILESCC(=O)Nc1cccc(NC(=O)c2ccc(F)c(Cl)c2)c1
InChIInChI=1S/C15H12ClFN2O2/c1-9(20)18-11-3-2-4-12(8-11)19-15(21)10-5-6-14(17)13(16)7-10/h2-8H,1H3,(H,18,20)(H,19,21)
InChIKeyUUMJLXUMWBTIJG-UHFFFAOYSA-N
MW306.72 g/mol
LogP3.69
Rot. Bonds3

About N-(3-acetamidophenyl)-3-chloro-4-fluorobenzamide

N-(3-acetamidophenyl)-3-chloro-4-fluorobenzamide (PubChem CID 110764762) has the molecular formula C15H12ClFN2O2 and a molecular weight of 306.72 g/mol. Its IUPAC name is N-(3-acetamidophenyl)-3-chloro-4-fluorobenzamide.

Molecular Properties

Compound NameN-(3-acetamidophenyl)-3-chloro-4-fluorobenzamide
PubChem CID110764762
Molecular FormulaC15H12ClFN2O2
Molecular Weight306.72 g/mol
Exact Mass306.06
IUPAC NameN-(3-acetamidophenyl)-3-chloro-4-fluorobenzamide
SMILESCC(=O)Nc1cccc(NC(=O)c2ccc(F)c(Cl)c2)c1
InChIInChI=1S/C15H12ClFN2O2/c1-9(20)18-11-3-2-4-12(8-11)19-15(21)10-5-6-14(17)13(16)7-10/h2-8H,1H3,(H,18,20)(H,19,21)
InChIKeyUUMJLXUMWBTIJG-UHFFFAOYSA-N
XLogP3.69
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.72
LogP ≤ 53.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

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N-(3-acetamidophenyl)-3-chlorobenzamide
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N-(3-acetamidophenyl)-3-amino-4-chlorobenzamide
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N-(3-acetamidophenyl)-3-[(4-fluorobenzoyl)amino]benzamide
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N-(3-acetamidophenyl)-3-chloro-4-(methanesulfonamido)benzamide
CID 92683312
N-(3-amino-4-chlorophenyl)-3-chloro-4-fluorobenzamide
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3-chloro-4-fluoro-N-(4-propan-2-ylphenyl)benzamide
CID 121261386
3,4-dichloro-N-[3-(2,2-dimethylpropanoylamino)phenyl]benzamide
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Frequently Asked Questions

What is the IUPAC name of N-(3-acetamidophenyl)-3-chloro-4-fluorobenzamide?
The IUPAC name of N-(3-acetamidophenyl)-3-chloro-4-fluorobenzamide (CID 110764762) is N-(3-acetamidophenyl)-3-chloro-4-fluorobenzamide.
What is the SMILES notation for N-(3-acetamidophenyl)-3-chloro-4-fluorobenzamide?
The canonical SMILES for N-(3-acetamidophenyl)-3-chloro-4-fluorobenzamide is CC(=O)Nc1cccc(NC(=O)c2ccc(F)c(Cl)c2)c1.
What is the InChIKey of N-(3-acetamidophenyl)-3-chloro-4-fluorobenzamide?
The InChIKey is UUMJLXUMWBTIJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12ClFN2O2/c1-9(20)18-11-3-2-4-12(8-11)19-15(21)10-5-6-14(17)13(16)7-10/h2-8H,1H3,(H,18,20)(H,19,21).
What are the key properties of N-(3-acetamidophenyl)-3-chloro-4-fluorobenzamide?
N-(3-acetamidophenyl)-3-chloro-4-fluorobenzamide has a molecular weight of 306.72 g/mol, XLogP of 3.69, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-acetamidophenyl)-3-chloro-4-fluorobenzamide is sourced from PubChem (CID 110764762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).