4-chloro-N-cyclopentyl-N-(phenylcarbamoyl)benzamide

C19H19ClN2O2 — CID 139595074

IUPAC4-chloro-N-cyclopentyl-N-(phenylcarbamoyl)benzamide
SMILESO=C(Nc1ccccc1)N(C(=O)c1ccc(Cl)cc1)C1CCCC1
InChIInChI=1S/C19H19ClN2O2/c20-15-12-10-14(11-13-15)18(23)22(17-8-4-5-9-17)19(24)21-16-6-2-1-3-7-16/h1-3,6-7,10-13,17H,4-5,8-9H2,(H,21,24)
InChIKeyGJHJWPXUSIMGEF-UHFFFAOYSA-N
MW342.83 g/mol
LogP4.96
Rot. Bonds3

About 4-chloro-N-cyclopentyl-N-(phenylcarbamoyl)benzamide

4-chloro-N-cyclopentyl-N-(phenylcarbamoyl)benzamide (PubChem CID 139595074) has the molecular formula C19H19ClN2O2 and a molecular weight of 342.83 g/mol. Its IUPAC name is 4-chloro-N-cyclopentyl-N-(phenylcarbamoyl)benzamide.

Molecular Properties

Compound Name4-chloro-N-cyclopentyl-N-(phenylcarbamoyl)benzamide
PubChem CID139595074
Molecular FormulaC19H19ClN2O2
Molecular Weight342.83 g/mol
Exact Mass342.11
IUPAC Name4-chloro-N-cyclopentyl-N-(phenylcarbamoyl)benzamide
SMILESO=C(Nc1ccccc1)N(C(=O)c1ccc(Cl)cc1)C1CCCC1
InChIInChI=1S/C19H19ClN2O2/c20-15-12-10-14(11-13-15)18(23)22(17-8-4-5-9-17)19(24)21-16-6-2-1-3-7-16/h1-3,6-7,10-13,17H,4-5,8-9H2,(H,21,24)
InChIKeyGJHJWPXUSIMGEF-UHFFFAOYSA-N
XLogP4.96
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.83
LogP ≤ 54.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-cyclopentyl-N-(phenylcarbamoyl)benzamide?
The IUPAC name of 4-chloro-N-cyclopentyl-N-(phenylcarbamoyl)benzamide (CID 139595074) is 4-chloro-N-cyclopentyl-N-(phenylcarbamoyl)benzamide.
What is the SMILES notation for 4-chloro-N-cyclopentyl-N-(phenylcarbamoyl)benzamide?
The canonical SMILES for 4-chloro-N-cyclopentyl-N-(phenylcarbamoyl)benzamide is O=C(Nc1ccccc1)N(C(=O)c1ccc(Cl)cc1)C1CCCC1.
What is the InChIKey of 4-chloro-N-cyclopentyl-N-(phenylcarbamoyl)benzamide?
The InChIKey is GJHJWPXUSIMGEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19ClN2O2/c20-15-12-10-14(11-13-15)18(23)22(17-8-4-5-9-17)19(24)21-16-6-2-1-3-7-16/h1-3,6-7,10-13,17H,4-5,8-9H2,(H,21,24).
What are the key properties of 4-chloro-N-cyclopentyl-N-(phenylcarbamoyl)benzamide?
4-chloro-N-cyclopentyl-N-(phenylcarbamoyl)benzamide has a molecular weight of 342.83 g/mol, XLogP of 4.96, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-cyclopentyl-N-(phenylcarbamoyl)benzamide is sourced from PubChem (CID 139595074), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).