4-ethyl-N-(2-pyrrolidin-1-ylethyl)piperidine-2-carboxamide

C14H27N3O — CID 114428071

IUPAC4-ethyl-N-(2-pyrrolidin-1-ylethyl)piperidine-2-carboxamide
SMILESCCC1CCNC(C(=O)NCCN2CCCC2)C1
InChIInChI=1S/C14H27N3O/c1-2-12-5-6-15-13(11-12)14(18)16-7-10-17-8-3-4-9-17/h12-13,15H,2-11H2,1H3,(H,16,18)
InChIKeyYKDNAKLXOXGWMV-UHFFFAOYSA-N
MW253.39 g/mol
LogP0.98
Rot. Bonds5

About 4-ethyl-N-(2-pyrrolidin-1-ylethyl)piperidine-2-carboxamide

4-ethyl-N-(2-pyrrolidin-1-ylethyl)piperidine-2-carboxamide (PubChem CID 114428071) has the molecular formula C14H27N3O and a molecular weight of 253.39 g/mol. Its IUPAC name is 4-ethyl-N-(2-pyrrolidin-1-ylethyl)piperidine-2-carboxamide.

Molecular Properties

Compound Name4-ethyl-N-(2-pyrrolidin-1-ylethyl)piperidine-2-carboxamide
PubChem CID114428071
Molecular FormulaC14H27N3O
Molecular Weight253.39 g/mol
Exact Mass253.22
IUPAC Name4-ethyl-N-(2-pyrrolidin-1-ylethyl)piperidine-2-carboxamide
SMILESCCC1CCNC(C(=O)NCCN2CCCC2)C1
InChIInChI=1S/C14H27N3O/c1-2-12-5-6-15-13(11-12)14(18)16-7-10-17-8-3-4-9-17/h12-13,15H,2-11H2,1H3,(H,16,18)
InChIKeyYKDNAKLXOXGWMV-UHFFFAOYSA-N
XLogP0.98
TPSA44.37 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 ≤ 50.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-ethyl-N-(2-methyl-3-piperidin-1-ylpropyl)piperidine-2-carboxamide
CID 114428586
4-ethyl-N-(2-oxo-2-pyrrolidin-1-ylethyl)piperidine-2-carboxamide
CID 114429484
(2S)-N-(2-pyrrolidin-1-ylethyl)pyrrolidine-2-carboxamide
CID 61154018
4-ethyl-N-(3-hydroxypropyl)piperidine-2-carboxamide
CID 114428024
4-ethyl-N-[(1-methylpiperidin-4-yl)methyl]piperidine-2-carboxamide
CID 114428843
4-ethyl-N-(4-hydroxybutyl)piperidine-2-carboxamide
CID 106841954
4-ethyl-N-(3-methyl-2-pyrrolidin-1-ylbutyl)piperidine-2-carboxamide
CID 114428726
N-(2-cyclopentyloxyethyl)-4-ethylpiperidine-2-carboxamide
CID 114429058
N-(cyclohexylmethyl)-4-ethylpiperidine-2-carboxamide
CID 114428046
4-ethyl-N-[2-(ethylamino)-2-oxoethyl]piperidine-2-carboxamide
CID 114428095
(2S,4S)-N-[2-(azepan-1-yl)ethyl]-2-methylpiperidine-4-carboxamide
CID 120632718
7-[(4-ethylpiperidine-2-carbonyl)amino]heptanoic acid
CID 114428646

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-N-(2-pyrrolidin-1-ylethyl)piperidine-2-carboxamide?
The IUPAC name of 4-ethyl-N-(2-pyrrolidin-1-ylethyl)piperidine-2-carboxamide (CID 114428071) is 4-ethyl-N-(2-pyrrolidin-1-ylethyl)piperidine-2-carboxamide.
What is the SMILES notation for 4-ethyl-N-(2-pyrrolidin-1-ylethyl)piperidine-2-carboxamide?
The canonical SMILES for 4-ethyl-N-(2-pyrrolidin-1-ylethyl)piperidine-2-carboxamide is CCC1CCNC(C(=O)NCCN2CCCC2)C1.
What is the InChIKey of 4-ethyl-N-(2-pyrrolidin-1-ylethyl)piperidine-2-carboxamide?
The InChIKey is YKDNAKLXOXGWMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N3O/c1-2-12-5-6-15-13(11-12)14(18)16-7-10-17-8-3-4-9-17/h12-13,15H,2-11H2,1H3,(H,16,18).
What are the key properties of 4-ethyl-N-(2-pyrrolidin-1-ylethyl)piperidine-2-carboxamide?
4-ethyl-N-(2-pyrrolidin-1-ylethyl)piperidine-2-carboxamide has a molecular weight of 253.39 g/mol, XLogP of 0.98, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-N-(2-pyrrolidin-1-ylethyl)piperidine-2-carboxamide is sourced from PubChem (CID 114428071), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).