N-(3-cyclopentylpropyl)-5-methylpiperazine-2-carboxamide

C14H27N3O — CID 114137524

IUPACN-(3-cyclopentylpropyl)-5-methylpiperazine-2-carboxamide
SMILESCC1CNC(C(=O)NCCCC2CCCC2)CN1
InChIInChI=1S/C14H27N3O/c1-11-9-17-13(10-16-11)14(18)15-8-4-7-12-5-2-3-6-12/h11-13,16-17H,2-10H2,1H3,(H,15,18)
InChIKeyJJSAJZHFJVFMCD-UHFFFAOYSA-N
MW253.39 g/mol
LogP1.02
Rot. Bonds5

About N-(3-cyclopentylpropyl)-5-methylpiperazine-2-carboxamide

N-(3-cyclopentylpropyl)-5-methylpiperazine-2-carboxamide (PubChem CID 114137524) has the molecular formula C14H27N3O and a molecular weight of 253.39 g/mol. Its IUPAC name is N-(3-cyclopentylpropyl)-5-methylpiperazine-2-carboxamide.

Molecular Properties

Compound NameN-(3-cyclopentylpropyl)-5-methylpiperazine-2-carboxamide
PubChem CID114137524
Molecular FormulaC14H27N3O
Molecular Weight253.39 g/mol
Exact Mass253.22
IUPAC NameN-(3-cyclopentylpropyl)-5-methylpiperazine-2-carboxamide
SMILESCC1CNC(C(=O)NCCCC2CCCC2)CN1
InChIInChI=1S/C14H27N3O/c1-11-9-17-13(10-16-11)14(18)15-8-4-7-12-5-2-3-6-12/h11-13,16-17H,2-10H2,1H3,(H,15,18)
InChIKeyJJSAJZHFJVFMCD-UHFFFAOYSA-N
XLogP1.02
TPSA53.16 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.39
LogP ≤ 51.02
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze N-(3-cyclopentylpropyl)-5-methylpiperazine-2-carboxamide 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

5-methyl-N-[2-(oxolan-2-yl)ethyl]piperazine-2-carboxamide
CID 63103322
5-methyl-N-(3-morpholin-4-ylpropyl)piperazine-2-carboxamide
CID 63102385
N-[2-[ethyl(methyl)amino]ethyl]-5-methylpiperazine-2-carboxamide
CID 63102583
N-(4-cyclopentylbutyl)-1,3-thiazolidine-4-carboxamide
CID 119327705
N-(3-cyclopentylpropyl)bicyclo[3.1.0]hexane-3-carboxamide
CID 106015861
N-(2-amino-2-oxoethyl)-5-methylpiperazine-2-carboxamide
CID 63102938
N-(2-cyclopentylethyl)-6-methylpiperidine-2-carboxamide
CID 54932990
N-(3-cyclopentylpropyl)-2,3,3a,4,5,6,7,7a-octahydro-1H-indole-2-carboxamide
CID 103795254
2-(3-cyclopentylpropylcarbamoyl)-4-methylcyclopentane-1-carboxylic acid
CID 106003676
N-(3-cyclopentylpropyl)-2,3,3a,4,5,6,7,7a-octahydro-1H-indole-2-carboxamide;hydrochloride
CID 119289828
5-methyl-N-(oxolan-2-ylmethyl)piperazine-2-carboxamide
CID 63102749
cis-(1S,3R)-3-(3-cyclopentylpropylcarbamoyl)cyclopentane-1-carboxylic acid
CID 114136262

Frequently Asked Questions

What is the IUPAC name of N-(3-cyclopentylpropyl)-5-methylpiperazine-2-carboxamide?
The IUPAC name of N-(3-cyclopentylpropyl)-5-methylpiperazine-2-carboxamide (CID 114137524) is N-(3-cyclopentylpropyl)-5-methylpiperazine-2-carboxamide.
What is the SMILES notation for N-(3-cyclopentylpropyl)-5-methylpiperazine-2-carboxamide?
The canonical SMILES for N-(3-cyclopentylpropyl)-5-methylpiperazine-2-carboxamide is CC1CNC(C(=O)NCCCC2CCCC2)CN1.
What is the InChIKey of N-(3-cyclopentylpropyl)-5-methylpiperazine-2-carboxamide?
The InChIKey is JJSAJZHFJVFMCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N3O/c1-11-9-17-13(10-16-11)14(18)15-8-4-7-12-5-2-3-6-12/h11-13,16-17H,2-10H2,1H3,(H,15,18).
What are the key properties of N-(3-cyclopentylpropyl)-5-methylpiperazine-2-carboxamide?
N-(3-cyclopentylpropyl)-5-methylpiperazine-2-carboxamide has a molecular weight of 253.39 g/mol, XLogP of 1.02, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-cyclopentylpropyl)-5-methylpiperazine-2-carboxamide is sourced from PubChem (CID 114137524), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).