1-amino-N-(3-piperidin-1-ylpropyl)cyclopentane-1-carboxamide

C14H27N3O — CID 60867938

IUPAC1-amino-N-(3-piperidin-1-ylpropyl)cyclopentane-1-carboxamide
SMILESNC1(C(=O)NCCCN2CCCCC2)CCCC1
InChIInChI=1S/C14H27N3O/c15-14(7-2-3-8-14)13(18)16-9-6-12-17-10-4-1-5-11-17/h1-12,15H2,(H,16,18)
InChIKeyHUKIZSVNKWPHDU-UHFFFAOYSA-N
MW253.39 g/mol
LogP1.25
Rot. Bonds5

About 1-amino-N-(3-piperidin-1-ylpropyl)cyclopentane-1-carboxamide

1-amino-N-(3-piperidin-1-ylpropyl)cyclopentane-1-carboxamide (PubChem CID 60867938) has the molecular formula C14H27N3O and a molecular weight of 253.39 g/mol. Its IUPAC name is 1-amino-N-(3-piperidin-1-ylpropyl)cyclopentane-1-carboxamide.

Molecular Properties

Compound Name1-amino-N-(3-piperidin-1-ylpropyl)cyclopentane-1-carboxamide
PubChem CID60867938
Molecular FormulaC14H27N3O
Molecular Weight253.39 g/mol
Exact Mass253.22
IUPAC Name1-amino-N-(3-piperidin-1-ylpropyl)cyclopentane-1-carboxamide
SMILESNC1(C(=O)NCCCN2CCCCC2)CCCC1
InChIInChI=1S/C14H27N3O/c15-14(7-2-3-8-14)13(18)16-9-6-12-17-10-4-1-5-11-17/h1-12,15H2,(H,16,18)
InChIKeyHUKIZSVNKWPHDU-UHFFFAOYSA-N
XLogP1.25
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.39
LogP ≤ 51.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-amino-N-(3-piperidin-1-ylpropyl)cyclopentane-1-carboxamide?
The IUPAC name of 1-amino-N-(3-piperidin-1-ylpropyl)cyclopentane-1-carboxamide (CID 60867938) is 1-amino-N-(3-piperidin-1-ylpropyl)cyclopentane-1-carboxamide.
What is the SMILES notation for 1-amino-N-(3-piperidin-1-ylpropyl)cyclopentane-1-carboxamide?
The canonical SMILES for 1-amino-N-(3-piperidin-1-ylpropyl)cyclopentane-1-carboxamide is NC1(C(=O)NCCCN2CCCCC2)CCCC1.
What is the InChIKey of 1-amino-N-(3-piperidin-1-ylpropyl)cyclopentane-1-carboxamide?
The InChIKey is HUKIZSVNKWPHDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N3O/c15-14(7-2-3-8-14)13(18)16-9-6-12-17-10-4-1-5-11-17/h1-12,15H2,(H,16,18).
What are the key properties of 1-amino-N-(3-piperidin-1-ylpropyl)cyclopentane-1-carboxamide?
1-amino-N-(3-piperidin-1-ylpropyl)cyclopentane-1-carboxamide has a molecular weight of 253.39 g/mol, XLogP of 1.25, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-N-(3-piperidin-1-ylpropyl)cyclopentane-1-carboxamide is sourced from PubChem (CID 60867938), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).