N-[2-(aminomethyl)cyclopentyl]-N-ethylpiperidine-1-carboxamide

C14H27N3O — CID 79155815

IUPACN-[2-(aminomethyl)cyclopentyl]-N-ethylpiperidine-1-carboxamide
SMILESCCN(C(=O)N1CCCCC1)C1CCCC1CN
InChIInChI=1S/C14H27N3O/c1-2-17(13-8-6-7-12(13)11-15)14(18)16-9-4-3-5-10-16/h12-13H,2-11,15H2,1H3
InChIKeyAWNVLEMFAFTQRC-UHFFFAOYSA-N
MW253.39 g/mol
LogP2.04
Rot. Bonds3

About N-[2-(aminomethyl)cyclopentyl]-N-ethylpiperidine-1-carboxamide

N-[2-(aminomethyl)cyclopentyl]-N-ethylpiperidine-1-carboxamide (PubChem CID 79155815) has the molecular formula C14H27N3O and a molecular weight of 253.39 g/mol. Its IUPAC name is N-[2-(aminomethyl)cyclopentyl]-N-ethylpiperidine-1-carboxamide.

Molecular Properties

Compound NameN-[2-(aminomethyl)cyclopentyl]-N-ethylpiperidine-1-carboxamide
PubChem CID79155815
Molecular FormulaC14H27N3O
Molecular Weight253.39 g/mol
Exact Mass253.22
IUPAC NameN-[2-(aminomethyl)cyclopentyl]-N-ethylpiperidine-1-carboxamide
SMILESCCN(C(=O)N1CCCCC1)C1CCCC1CN
InChIInChI=1S/C14H27N3O/c1-2-17(13-8-6-7-12(13)11-15)14(18)16-9-4-3-5-10-16/h12-13H,2-11,15H2,1H3
InChIKeyAWNVLEMFAFTQRC-UHFFFAOYSA-N
XLogP2.04
TPSA49.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.39
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[2-(aminomethyl)cyclopentyl]-N-ethylpiperidine-1-carboxamide?
The IUPAC name of N-[2-(aminomethyl)cyclopentyl]-N-ethylpiperidine-1-carboxamide (CID 79155815) is N-[2-(aminomethyl)cyclopentyl]-N-ethylpiperidine-1-carboxamide.
What is the SMILES notation for N-[2-(aminomethyl)cyclopentyl]-N-ethylpiperidine-1-carboxamide?
The canonical SMILES for N-[2-(aminomethyl)cyclopentyl]-N-ethylpiperidine-1-carboxamide is CCN(C(=O)N1CCCCC1)C1CCCC1CN.
What is the InChIKey of N-[2-(aminomethyl)cyclopentyl]-N-ethylpiperidine-1-carboxamide?
The InChIKey is AWNVLEMFAFTQRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N3O/c1-2-17(13-8-6-7-12(13)11-15)14(18)16-9-4-3-5-10-16/h12-13H,2-11,15H2,1H3.
What are the key properties of N-[2-(aminomethyl)cyclopentyl]-N-ethylpiperidine-1-carboxamide?
N-[2-(aminomethyl)cyclopentyl]-N-ethylpiperidine-1-carboxamide has a molecular weight of 253.39 g/mol, XLogP of 2.04, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(aminomethyl)cyclopentyl]-N-ethylpiperidine-1-carboxamide is sourced from PubChem (CID 79155815), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).