2-benzyl-N-(2-chloro-4-fluorophenyl)benzamide

C20H15ClFNO — CID 26364255

IUPAC2-benzyl-N-(2-chloro-4-fluorophenyl)benzamide
SMILESO=C(Nc1ccc(F)cc1Cl)c1ccccc1Cc1ccccc1
InChIInChI=1S/C20H15ClFNO/c21-18-13-16(22)10-11-19(18)23-20(24)17-9-5-4-8-15(17)12-14-6-2-1-3-7-14/h1-11,13H,12H2,(H,23,24)
InChIKeyKMQDQUZSMIABSH-UHFFFAOYSA-N
MW339.80 g/mol
LogP5.32
Rot. Bonds4

About 2-benzyl-N-(2-chloro-4-fluorophenyl)benzamide

2-benzyl-N-(2-chloro-4-fluorophenyl)benzamide (PubChem CID 26364255) has the molecular formula C20H15ClFNO and a molecular weight of 339.80 g/mol. Its IUPAC name is 2-benzyl-N-(2-chloro-4-fluorophenyl)benzamide.

Molecular Properties

Compound Name2-benzyl-N-(2-chloro-4-fluorophenyl)benzamide
PubChem CID26364255
Molecular FormulaC20H15ClFNO
Molecular Weight339.80 g/mol
Exact Mass339.08
IUPAC Name2-benzyl-N-(2-chloro-4-fluorophenyl)benzamide
SMILESO=C(Nc1ccc(F)cc1Cl)c1ccccc1Cc1ccccc1
InChIInChI=1S/C20H15ClFNO/c21-18-13-16(22)10-11-19(18)23-20(24)17-9-5-4-8-15(17)12-14-6-2-1-3-7-14/h1-11,13H,12H2,(H,23,24)
InChIKeyKMQDQUZSMIABSH-UHFFFAOYSA-N
XLogP5.32
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500339.80
LogP ≤ 55.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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CID 87114822
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CID 30705488
(2R)-2-benzylsulfanyl-N-(2-chloro-4-fluorophenyl)propanamide
CID 7377182
N-(2-chloro-4-fluorophenyl)-5-methyl-2-(methylamino)benzamide
CID 62511235
N-(2-chloro-4-fluorophenyl)-2-methylquinoline-4-carboxamide
CID 26364307
N-(2-benzyl-4-fluorophenyl)-2-hydroxyacetamide
CID 67711823
N-(2-chloro-4-fluorophenyl)-4-(2-phenylethynyl)benzamide
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Frequently Asked Questions

What is the IUPAC name of 2-benzyl-N-(2-chloro-4-fluorophenyl)benzamide?
The IUPAC name of 2-benzyl-N-(2-chloro-4-fluorophenyl)benzamide (CID 26364255) is 2-benzyl-N-(2-chloro-4-fluorophenyl)benzamide.
What is the SMILES notation for 2-benzyl-N-(2-chloro-4-fluorophenyl)benzamide?
The canonical SMILES for 2-benzyl-N-(2-chloro-4-fluorophenyl)benzamide is O=C(Nc1ccc(F)cc1Cl)c1ccccc1Cc1ccccc1.
What is the InChIKey of 2-benzyl-N-(2-chloro-4-fluorophenyl)benzamide?
The InChIKey is KMQDQUZSMIABSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15ClFNO/c21-18-13-16(22)10-11-19(18)23-20(24)17-9-5-4-8-15(17)12-14-6-2-1-3-7-14/h1-11,13H,12H2,(H,23,24).
What are the key properties of 2-benzyl-N-(2-chloro-4-fluorophenyl)benzamide?
2-benzyl-N-(2-chloro-4-fluorophenyl)benzamide has a molecular weight of 339.80 g/mol, XLogP of 5.32, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-benzyl-N-(2-chloro-4-fluorophenyl)benzamide is sourced from PubChem (CID 26364255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).