N-[(4-chlorophenyl)carbamoyl]-2,4-difluorobenzamide

C14H9ClF2N2O2 — CID 2823829

IUPACN-[(4-chlorophenyl)carbamoyl]-2,4-difluorobenzamide
SMILESO=C(NC(=O)c1ccc(F)cc1F)Nc1ccc(Cl)cc1
InChIInChI=1S/C14H9ClF2N2O2/c15-8-1-4-10(5-2-8)18-14(21)19-13(20)11-6-3-9(16)7-12(11)17/h1-7H,(H2,18,19,20,21)
InChIKeyJUANCPYMKFWATC-UHFFFAOYSA-N
MW310.69 g/mol
LogP3.58
Rot. Bonds2

About N-[(4-chlorophenyl)carbamoyl]-2,4-difluorobenzamide

N-[(4-chlorophenyl)carbamoyl]-2,4-difluorobenzamide (PubChem CID 2823829) has the molecular formula C14H9ClF2N2O2 and a molecular weight of 310.69 g/mol. Its IUPAC name is N-[(4-chlorophenyl)carbamoyl]-2,4-difluorobenzamide.

Molecular Properties

Compound NameN-[(4-chlorophenyl)carbamoyl]-2,4-difluorobenzamide
PubChem CID2823829
Molecular FormulaC14H9ClF2N2O2
Molecular Weight310.69 g/mol
Exact Mass310.03
IUPAC NameN-[(4-chlorophenyl)carbamoyl]-2,4-difluorobenzamide
SMILESO=C(NC(=O)c1ccc(F)cc1F)Nc1ccc(Cl)cc1
InChIInChI=1S/C14H9ClF2N2O2/c15-8-1-4-10(5-2-8)18-14(21)19-13(20)11-6-3-9(16)7-12(11)17/h1-7H,(H2,18,19,20,21)
InChIKeyJUANCPYMKFWATC-UHFFFAOYSA-N
XLogP3.58
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.69
LogP ≤ 53.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

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Benzamide, N-(4-chlorophenyl)-
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N-(3-Chlorophenyl)benzamide
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N-(2-Chlorophenyl)benzamide
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N-(4-Acetylphenyl)-N'-(3-chlorophenyl)urea
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1-Benzoyl-3-phenylurea
CID 74566
N-(4-Chlorophenyl)-3-oxo-3-phenylpropanamide
CID 570768
N-(((2-Chlorophenyl)amino)thioxomethyl)benzamide
CID 692093
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CID 701011

Frequently Asked Questions

What is the IUPAC name of N-[(4-chlorophenyl)carbamoyl]-2,4-difluorobenzamide?
The IUPAC name of N-[(4-chlorophenyl)carbamoyl]-2,4-difluorobenzamide (CID 2823829) is N-[(4-chlorophenyl)carbamoyl]-2,4-difluorobenzamide.
What is the SMILES notation for N-[(4-chlorophenyl)carbamoyl]-2,4-difluorobenzamide?
The canonical SMILES for N-[(4-chlorophenyl)carbamoyl]-2,4-difluorobenzamide is O=C(NC(=O)c1ccc(F)cc1F)Nc1ccc(Cl)cc1.
What is the InChIKey of N-[(4-chlorophenyl)carbamoyl]-2,4-difluorobenzamide?
The InChIKey is JUANCPYMKFWATC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H9ClF2N2O2/c15-8-1-4-10(5-2-8)18-14(21)19-13(20)11-6-3-9(16)7-12(11)17/h1-7H,(H2,18,19,20,21).
What are the key properties of N-[(4-chlorophenyl)carbamoyl]-2,4-difluorobenzamide?
N-[(4-chlorophenyl)carbamoyl]-2,4-difluorobenzamide has a molecular weight of 310.69 g/mol, XLogP of 3.58, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-chlorophenyl)carbamoyl]-2,4-difluorobenzamide is sourced from PubChem (CID 2823829), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).