N-[2-(4-cyclopentylpiperazin-1-yl)ethyl]propan-1-amine

C14H29N3 — CID 62369763

IUPACN-[2-(4-cyclopentylpiperazin-1-yl)ethyl]propan-1-amine
SMILESCCCNCCN1CCN(C2CCCC2)CC1
InChIInChI=1S/C14H29N3/c1-2-7-15-8-9-16-10-12-17(13-11-16)14-5-3-4-6-14/h14-15H,2-13H2,1H3
InChIKeyDLYGRXZKCQISSS-UHFFFAOYSA-N
MW239.41 g/mol
LogP1.55
Rot. Bonds6

About N-[2-(4-cyclopentylpiperazin-1-yl)ethyl]propan-1-amine

N-[2-(4-cyclopentylpiperazin-1-yl)ethyl]propan-1-amine (PubChem CID 62369763) has the molecular formula C14H29N3 and a molecular weight of 239.41 g/mol. Its IUPAC name is N-[2-(4-cyclopentylpiperazin-1-yl)ethyl]propan-1-amine.

Molecular Properties

Compound NameN-[2-(4-cyclopentylpiperazin-1-yl)ethyl]propan-1-amine
PubChem CID62369763
Molecular FormulaC14H29N3
Molecular Weight239.41 g/mol
Exact Mass239.24
IUPAC NameN-[2-(4-cyclopentylpiperazin-1-yl)ethyl]propan-1-amine
SMILESCCCNCCN1CCN(C2CCCC2)CC1
InChIInChI=1S/C14H29N3/c1-2-7-15-8-9-16-10-12-17(13-11-16)14-5-3-4-6-14/h14-15H,2-13H2,1H3
InChIKeyDLYGRXZKCQISSS-UHFFFAOYSA-N
XLogP1.55
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.41
LogP ≤ 51.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze N-[2-(4-cyclopentylpiperazin-1-yl)ethyl]propan-1-amine 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

4-(4-cyclopentylpiperazin-1-yl)-N-ethylbutan-1-amine
CID 62448794
5-(4-cyclopentylpiperazin-1-yl)-N-ethylpentan-1-amine
CID 62446737
1-(4-cyclopentylpiperazin-1-yl)-3-(propylamino)propan-2-ol
CID 55063736
N-propyl-N'-(2-pyrrolidin-1-ylethyl)ethane-1,2-diamine
CID 53215588
N-[2-(4-cyclopropylpiperazin-1-yl)ethyl]-3,3-dimethylbutan-1-amine
CID 62556729
N-[2-(4-methyl-1,4-diazepan-1-yl)ethyl]propan-1-amine
CID 61386658
N-[2-(4-cyclopropylpiperazin-1-yl)ethyl]-4-methylpentan-1-amine
CID 62556377
N-[[2-(4-cyclopentylpiperazin-1-yl)cyclobutyl]methyl]propan-1-amine
CID 80997839
N-[2-(1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-yl)ethyl]prop-2-yn-1-amine
CID 79935542
1-(2-chloroethyl)-4-cyclopentylpiperazine
CID 4741622
1-cyclohexyl-4-ethylpiperazine;hydrochloride
CID 44598236
N-[2-(4-cyclopentylpiperazin-1-yl)ethyl]-3-methylcyclohexan-1-amine
CID 62561082

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-cyclopentylpiperazin-1-yl)ethyl]propan-1-amine?
The IUPAC name of N-[2-(4-cyclopentylpiperazin-1-yl)ethyl]propan-1-amine (CID 62369763) is N-[2-(4-cyclopentylpiperazin-1-yl)ethyl]propan-1-amine.
What is the SMILES notation for N-[2-(4-cyclopentylpiperazin-1-yl)ethyl]propan-1-amine?
The canonical SMILES for N-[2-(4-cyclopentylpiperazin-1-yl)ethyl]propan-1-amine is CCCNCCN1CCN(C2CCCC2)CC1.
What is the InChIKey of N-[2-(4-cyclopentylpiperazin-1-yl)ethyl]propan-1-amine?
The InChIKey is DLYGRXZKCQISSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N3/c1-2-7-15-8-9-16-10-12-17(13-11-16)14-5-3-4-6-14/h14-15H,2-13H2,1H3.
What are the key properties of N-[2-(4-cyclopentylpiperazin-1-yl)ethyl]propan-1-amine?
N-[2-(4-cyclopentylpiperazin-1-yl)ethyl]propan-1-amine has a molecular weight of 239.41 g/mol, XLogP of 1.55, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-cyclopentylpiperazin-1-yl)ethyl]propan-1-amine is sourced from PubChem (CID 62369763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).