2-(4-cyclopentylpiperazin-1-yl)quinoline

C18H23N3 — CID 11337173

IUPAC2-(4-cyclopentylpiperazin-1-yl)quinoline
SMILESc1ccc2nc(N3CCN(C4CCCC4)CC3)ccc2c1
InChIInChI=1S/C18H23N3/c1-4-8-17-15(5-1)9-10-18(19-17)21-13-11-20(12-14-21)16-6-2-3-7-16/h1,4-5,8-10,16H,2-3,6-7,11-14H2
InChIKeyJGCMOVVEQUHZRT-UHFFFAOYSA-N
MW281.40 g/mol
LogP3.30
Rot. Bonds2

About 2-(4-cyclopentylpiperazin-1-yl)quinoline

2-(4-cyclopentylpiperazin-1-yl)quinoline (PubChem CID 11337173) has the molecular formula C18H23N3 and a molecular weight of 281.40 g/mol. Its IUPAC name is 2-(4-cyclopentylpiperazin-1-yl)quinoline.

Molecular Properties

Compound Name2-(4-cyclopentylpiperazin-1-yl)quinoline
PubChem CID11337173
Molecular FormulaC18H23N3
Molecular Weight281.40 g/mol
Exact Mass281.19
IUPAC Name2-(4-cyclopentylpiperazin-1-yl)quinoline
SMILESc1ccc2nc(N3CCN(C4CCCC4)CC3)ccc2c1
InChIInChI=1S/C18H23N3/c1-4-8-17-15(5-1)9-10-18(19-17)21-13-11-20(12-14-21)16-6-2-3-7-16/h1,4-5,8-10,16H,2-3,6-7,11-14H2
InChIKeyJGCMOVVEQUHZRT-UHFFFAOYSA-N
XLogP3.30
TPSA19.37 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.40
LogP ≤ 53.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 2-(4-cyclopentylpiperazin-1-yl)quinoline 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-(4-cyclopentylpiperazin-1-yl)quinoline?
The IUPAC name of 2-(4-cyclopentylpiperazin-1-yl)quinoline (CID 11337173) is 2-(4-cyclopentylpiperazin-1-yl)quinoline.
What is the SMILES notation for 2-(4-cyclopentylpiperazin-1-yl)quinoline?
The canonical SMILES for 2-(4-cyclopentylpiperazin-1-yl)quinoline is c1ccc2nc(N3CCN(C4CCCC4)CC3)ccc2c1.
What is the InChIKey of 2-(4-cyclopentylpiperazin-1-yl)quinoline?
The InChIKey is JGCMOVVEQUHZRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N3/c1-4-8-17-15(5-1)9-10-18(19-17)21-13-11-20(12-14-21)16-6-2-3-7-16/h1,4-5,8-10,16H,2-3,6-7,11-14H2.
What are the key properties of 2-(4-cyclopentylpiperazin-1-yl)quinoline?
2-(4-cyclopentylpiperazin-1-yl)quinoline has a molecular weight of 281.40 g/mol, XLogP of 3.30, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-cyclopentylpiperazin-1-yl)quinoline is sourced from PubChem (CID 11337173), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).