2-[1-(4-chlorophenyl)pyrrol-2-yl]-N-cyclopentylacetamide

C17H19ClN2O — CID 53147922

IUPAC2-[1-(4-chlorophenyl)pyrrol-2-yl]-N-cyclopentylacetamide
SMILESO=C(Cc1cccn1-c1ccc(Cl)cc1)NC1CCCC1
InChIInChI=1S/C17H19ClN2O/c18-13-7-9-15(10-8-13)20-11-3-6-16(20)12-17(21)19-14-4-1-2-5-14/h3,6-11,14H,1-2,4-5,12H2,(H,19,21)
InChIKeyOVAVLBBUIUAOQZ-UHFFFAOYSA-N
MW302.81 g/mol
LogP3.73
Rot. Bonds4

About 2-[1-(4-chlorophenyl)pyrrol-2-yl]-N-cyclopentylacetamide

2-[1-(4-chlorophenyl)pyrrol-2-yl]-N-cyclopentylacetamide (PubChem CID 53147922) has the molecular formula C17H19ClN2O and a molecular weight of 302.81 g/mol. Its IUPAC name is 2-[1-(4-chlorophenyl)pyrrol-2-yl]-N-cyclopentylacetamide.

Molecular Properties

Compound Name2-[1-(4-chlorophenyl)pyrrol-2-yl]-N-cyclopentylacetamide
PubChem CID53147922
Molecular FormulaC17H19ClN2O
Molecular Weight302.81 g/mol
Exact Mass302.12
IUPAC Name2-[1-(4-chlorophenyl)pyrrol-2-yl]-N-cyclopentylacetamide
SMILESO=C(Cc1cccn1-c1ccc(Cl)cc1)NC1CCCC1
InChIInChI=1S/C17H19ClN2O/c18-13-7-9-15(10-8-13)20-11-3-6-16(20)12-17(21)19-14-4-1-2-5-14/h3,6-11,14H,1-2,4-5,12H2,(H,19,21)
InChIKeyOVAVLBBUIUAOQZ-UHFFFAOYSA-N
XLogP3.73
TPSA34.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.81
LogP ≤ 53.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-[1-(4-chlorophenyl)pyrrol-2-yl]-N-cyclopentylacetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-[1-(4-chlorophenyl)pyrrol-2-yl]-N-cyclopentylacetamide?
The IUPAC name of 2-[1-(4-chlorophenyl)pyrrol-2-yl]-N-cyclopentylacetamide (CID 53147922) is 2-[1-(4-chlorophenyl)pyrrol-2-yl]-N-cyclopentylacetamide.
What is the SMILES notation for 2-[1-(4-chlorophenyl)pyrrol-2-yl]-N-cyclopentylacetamide?
The canonical SMILES for 2-[1-(4-chlorophenyl)pyrrol-2-yl]-N-cyclopentylacetamide is O=C(Cc1cccn1-c1ccc(Cl)cc1)NC1CCCC1.
What is the InChIKey of 2-[1-(4-chlorophenyl)pyrrol-2-yl]-N-cyclopentylacetamide?
The InChIKey is OVAVLBBUIUAOQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19ClN2O/c18-13-7-9-15(10-8-13)20-11-3-6-16(20)12-17(21)19-14-4-1-2-5-14/h3,6-11,14H,1-2,4-5,12H2,(H,19,21).
What are the key properties of 2-[1-(4-chlorophenyl)pyrrol-2-yl]-N-cyclopentylacetamide?
2-[1-(4-chlorophenyl)pyrrol-2-yl]-N-cyclopentylacetamide has a molecular weight of 302.81 g/mol, XLogP of 3.73, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(4-chlorophenyl)pyrrol-2-yl]-N-cyclopentylacetamide is sourced from PubChem (CID 53147922), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).