2-benzyl-N-(2-chlorophenyl)benzamide

C20H16ClNO — CID 2121099

IUPAC2-benzyl-N-(2-chlorophenyl)benzamide
SMILESO=C(Nc1ccccc1Cl)c1ccccc1Cc1ccccc1
InChIInChI=1S/C20H16ClNO/c21-18-12-6-7-13-19(18)22-20(23)17-11-5-4-10-16(17)14-15-8-2-1-3-9-15/h1-13H,14H2,(H,22,23)
InChIKeyLRHVSIMZFWKWJR-UHFFFAOYSA-N
MW321.81 g/mol
LogP5.18
Rot. Bonds4

About 2-benzyl-N-(2-chlorophenyl)benzamide

2-benzyl-N-(2-chlorophenyl)benzamide (PubChem CID 2121099) has the molecular formula C20H16ClNO and a molecular weight of 321.81 g/mol. Its IUPAC name is 2-benzyl-N-(2-chlorophenyl)benzamide.

Molecular Properties

Compound Name2-benzyl-N-(2-chlorophenyl)benzamide
PubChem CID2121099
Molecular FormulaC20H16ClNO
Molecular Weight321.81 g/mol
Exact Mass321.09
IUPAC Name2-benzyl-N-(2-chlorophenyl)benzamide
SMILESO=C(Nc1ccccc1Cl)c1ccccc1Cc1ccccc1
InChIInChI=1S/C20H16ClNO/c21-18-12-6-7-13-19(18)22-20(23)17-11-5-4-10-16(17)14-15-8-2-1-3-9-15/h1-13H,14H2,(H,22,23)
InChIKeyLRHVSIMZFWKWJR-UHFFFAOYSA-N
XLogP5.18
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500321.81
LogP ≤ 55.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-benzyl-N-(2-chlorophenyl)benzamide?
The IUPAC name of 2-benzyl-N-(2-chlorophenyl)benzamide (CID 2121099) is 2-benzyl-N-(2-chlorophenyl)benzamide.
What is the SMILES notation for 2-benzyl-N-(2-chlorophenyl)benzamide?
The canonical SMILES for 2-benzyl-N-(2-chlorophenyl)benzamide is O=C(Nc1ccccc1Cl)c1ccccc1Cc1ccccc1.
What is the InChIKey of 2-benzyl-N-(2-chlorophenyl)benzamide?
The InChIKey is LRHVSIMZFWKWJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16ClNO/c21-18-12-6-7-13-19(18)22-20(23)17-11-5-4-10-16(17)14-15-8-2-1-3-9-15/h1-13H,14H2,(H,22,23).
What are the key properties of 2-benzyl-N-(2-chlorophenyl)benzamide?
2-benzyl-N-(2-chlorophenyl)benzamide has a molecular weight of 321.81 g/mol, XLogP of 5.18, 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-chlorophenyl)benzamide is sourced from PubChem (CID 2121099), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).