2-(4-cyclopentylpiperazin-1-yl)butanoic acid

C13H24N2O2 — CID 62368953

IUPAC2-(4-cyclopentylpiperazin-1-yl)butanoic acid
SMILESCCC(C(=O)O)N1CCN(C2CCCC2)CC1
InChIInChI=1S/C13H24N2O2/c1-2-12(13(16)17)15-9-7-14(8-10-15)11-5-3-4-6-11/h11-12H,2-10H2,1H3,(H,16,17)
InChIKeyPJTKYGBMHJDTPZ-UHFFFAOYSA-N
MW240.35 g/mol
LogP1.41
Rot. Bonds4

About 2-(4-cyclopentylpiperazin-1-yl)butanoic acid

2-(4-cyclopentylpiperazin-1-yl)butanoic acid (PubChem CID 62368953) has the molecular formula C13H24N2O2 and a molecular weight of 240.35 g/mol. Its IUPAC name is 2-(4-cyclopentylpiperazin-1-yl)butanoic acid.

Molecular Properties

Compound Name2-(4-cyclopentylpiperazin-1-yl)butanoic acid
PubChem CID62368953
Molecular FormulaC13H24N2O2
Molecular Weight240.35 g/mol
Exact Mass240.18
IUPAC Name2-(4-cyclopentylpiperazin-1-yl)butanoic acid
SMILESCCC(C(=O)O)N1CCN(C2CCCC2)CC1
InChIInChI=1S/C13H24N2O2/c1-2-12(13(16)17)15-9-7-14(8-10-15)11-5-3-4-6-11/h11-12H,2-10H2,1H3,(H,16,17)
InChIKeyPJTKYGBMHJDTPZ-UHFFFAOYSA-N
XLogP1.41
TPSA43.78 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 51.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-(4-cyclopentylpiperazin-1-yl)butanoic acid with MolForge

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

Launch Full Analysis

Related Compounds

1-butan-2-yl-4-cyclohexylpiperazine;oxalic acid
CID 17369821
2-(3-piperidin-1-ylpyrrolidin-1-yl)butanoic acid
CID 63170614
2-(azocan-1-yl)butanoic acid
CID 43808973
2-(4-cyclopropylpiperazin-1-yl)-3-methoxypropanoic acid
CID 103224616
(2R)-2-[4-(cyclopropanecarbonyl)piperazin-1-yl]butanoic acid
CID 129495739
2-[4-(1-hydroxyethyl)piperidin-1-yl]butanoic acid
CID 103519870
2-(4-aminopiperidin-1-yl)butanoic acid;hydrochloride
CID 138695310
2-(3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)butanamide
CID 78945283
1,4-dicyclopentylpiperazine;oxalic acid
CID 17369822
1-(4-cyclopentylpiperazin-1-yl)-2-ethylbutan-1-one
CID 110708879
ethyl 2-(4-cyclopentylpiperazin-1-yl)propanoate
CID 55063212
2-(3-methylpiperidin-1-yl)butanoic acid
CID 43235109

Frequently Asked Questions

What is the IUPAC name of 2-(4-cyclopentylpiperazin-1-yl)butanoic acid?
The IUPAC name of 2-(4-cyclopentylpiperazin-1-yl)butanoic acid (CID 62368953) is 2-(4-cyclopentylpiperazin-1-yl)butanoic acid.
What is the SMILES notation for 2-(4-cyclopentylpiperazin-1-yl)butanoic acid?
The canonical SMILES for 2-(4-cyclopentylpiperazin-1-yl)butanoic acid is CCC(C(=O)O)N1CCN(C2CCCC2)CC1.
What is the InChIKey of 2-(4-cyclopentylpiperazin-1-yl)butanoic acid?
The InChIKey is PJTKYGBMHJDTPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O2/c1-2-12(13(16)17)15-9-7-14(8-10-15)11-5-3-4-6-11/h11-12H,2-10H2,1H3,(H,16,17).
What are the key properties of 2-(4-cyclopentylpiperazin-1-yl)butanoic acid?
2-(4-cyclopentylpiperazin-1-yl)butanoic acid has a molecular weight of 240.35 g/mol, XLogP of 1.41, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-cyclopentylpiperazin-1-yl)butanoic acid is sourced from PubChem (CID 62368953), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).