2-(4-chloro-3-fluorophenyl)benzamide

C13H9ClFNO — CID 15982090

IUPAC2-(4-chloro-3-fluorophenyl)benzamide
SMILESNC(=O)c1ccccc1-c1ccc(Cl)c(F)c1
InChIInChI=1S/C13H9ClFNO/c14-11-6-5-8(7-12(11)15)9-3-1-2-4-10(9)13(16)17/h1-7H,(H2,16,17)
InChIKeyYHRHZYYOSJFACN-UHFFFAOYSA-N
MW249.67 g/mol
LogP3.24
Rot. Bonds2

About 2-(4-chloro-3-fluorophenyl)benzamide

2-(4-chloro-3-fluorophenyl)benzamide (PubChem CID 15982090) has the molecular formula C13H9ClFNO and a molecular weight of 249.67 g/mol. Its IUPAC name is 2-(4-chloro-3-fluorophenyl)benzamide.

Molecular Properties

Compound Name2-(4-chloro-3-fluorophenyl)benzamide
PubChem CID15982090
Molecular FormulaC13H9ClFNO
Molecular Weight249.67 g/mol
Exact Mass249.04
IUPAC Name2-(4-chloro-3-fluorophenyl)benzamide
SMILESNC(=O)c1ccccc1-c1ccc(Cl)c(F)c1
InChIInChI=1S/C13H9ClFNO/c14-11-6-5-8(7-12(11)15)9-3-1-2-4-10(9)13(16)17/h1-7H,(H2,16,17)
InChIKeyYHRHZYYOSJFACN-UHFFFAOYSA-N
XLogP3.24
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.67
LogP ≤ 53.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-(4-chloro-3-fluorophenyl)benzamide?
The IUPAC name of 2-(4-chloro-3-fluorophenyl)benzamide (CID 15982090) is 2-(4-chloro-3-fluorophenyl)benzamide.
What is the SMILES notation for 2-(4-chloro-3-fluorophenyl)benzamide?
The canonical SMILES for 2-(4-chloro-3-fluorophenyl)benzamide is NC(=O)c1ccccc1-c1ccc(Cl)c(F)c1.
What is the InChIKey of 2-(4-chloro-3-fluorophenyl)benzamide?
The InChIKey is YHRHZYYOSJFACN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9ClFNO/c14-11-6-5-8(7-12(11)15)9-3-1-2-4-10(9)13(16)17/h1-7H,(H2,16,17).
What are the key properties of 2-(4-chloro-3-fluorophenyl)benzamide?
2-(4-chloro-3-fluorophenyl)benzamide has a molecular weight of 249.67 g/mol, XLogP of 3.24, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chloro-3-fluorophenyl)benzamide is sourced from PubChem (CID 15982090), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).