N-cyclopentyl-3-[(4-methylbenzoyl)amino]benzamide

C20H22N2O2 — CID 2221852

IUPACN-cyclopentyl-3-[(4-methylbenzoyl)amino]benzamide
SMILESCc1ccc(C(=O)Nc2cccc(C(=O)NC3CCCC3)c2)cc1
InChIInChI=1S/C20H22N2O2/c1-14-9-11-15(12-10-14)19(23)22-18-8-4-5-16(13-18)20(24)21-17-6-2-3-7-17/h4-5,8-13,17H,2-3,6-7H2,1H3,(H,21,24)(H,22,23)
InChIKeyJCUITXLTYOKUTC-UHFFFAOYSA-N
MW322.41 g/mol
LogP3.92
Rot. Bonds4

About N-cyclopentyl-3-[(4-methylbenzoyl)amino]benzamide

N-cyclopentyl-3-[(4-methylbenzoyl)amino]benzamide (PubChem CID 2221852) has the molecular formula C20H22N2O2 and a molecular weight of 322.41 g/mol. Its IUPAC name is N-cyclopentyl-3-[(4-methylbenzoyl)amino]benzamide.

Molecular Properties

Compound NameN-cyclopentyl-3-[(4-methylbenzoyl)amino]benzamide
PubChem CID2221852
Molecular FormulaC20H22N2O2
Molecular Weight322.41 g/mol
Exact Mass322.17
IUPAC NameN-cyclopentyl-3-[(4-methylbenzoyl)amino]benzamide
SMILESCc1ccc(C(=O)Nc2cccc(C(=O)NC3CCCC3)c2)cc1
InChIInChI=1S/C20H22N2O2/c1-14-9-11-15(12-10-14)19(23)22-18-8-4-5-16(13-18)20(24)21-17-6-2-3-7-17/h4-5,8-13,17H,2-3,6-7H2,1H3,(H,21,24)(H,22,23)
InChIKeyJCUITXLTYOKUTC-UHFFFAOYSA-N
XLogP3.92
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.41
LogP ≤ 53.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-3-[(4-methylbenzoyl)amino]benzamide?
The IUPAC name of N-cyclopentyl-3-[(4-methylbenzoyl)amino]benzamide (CID 2221852) is N-cyclopentyl-3-[(4-methylbenzoyl)amino]benzamide.
What is the SMILES notation for N-cyclopentyl-3-[(4-methylbenzoyl)amino]benzamide?
The canonical SMILES for N-cyclopentyl-3-[(4-methylbenzoyl)amino]benzamide is Cc1ccc(C(=O)Nc2cccc(C(=O)NC3CCCC3)c2)cc1.
What is the InChIKey of N-cyclopentyl-3-[(4-methylbenzoyl)amino]benzamide?
The InChIKey is JCUITXLTYOKUTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N2O2/c1-14-9-11-15(12-10-14)19(23)22-18-8-4-5-16(13-18)20(24)21-17-6-2-3-7-17/h4-5,8-13,17H,2-3,6-7H2,1H3,(H,21,24)(H,22,23).
What are the key properties of N-cyclopentyl-3-[(4-methylbenzoyl)amino]benzamide?
N-cyclopentyl-3-[(4-methylbenzoyl)amino]benzamide has a molecular weight of 322.41 g/mol, XLogP of 3.92, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-3-[(4-methylbenzoyl)amino]benzamide is sourced from PubChem (CID 2221852), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).