3-ethyl-N-(1-pyridin-4-ylethyl)piperidine-3-carboxamide

C15H23N3O — CID 63130581

IUPAC3-ethyl-N-(1-pyridin-4-ylethyl)piperidine-3-carboxamide
SMILESCCC1(C(=O)NC(C)c2ccncc2)CCCNC1
InChIInChI=1S/C15H23N3O/c1-3-15(7-4-8-17-11-15)14(19)18-12(2)13-5-9-16-10-6-13/h5-6,9-10,12,17H,3-4,7-8,11H2,1-2H3,(H,18,19)
InChIKeyPOPVPNYYMZCBER-UHFFFAOYSA-N
MW261.37 g/mol
LogP2.04
Rot. Bonds4

About 3-ethyl-N-(1-pyridin-4-ylethyl)piperidine-3-carboxamide

3-ethyl-N-(1-pyridin-4-ylethyl)piperidine-3-carboxamide (PubChem CID 63130581) has the molecular formula C15H23N3O and a molecular weight of 261.37 g/mol. Its IUPAC name is 3-ethyl-N-(1-pyridin-4-ylethyl)piperidine-3-carboxamide.

Molecular Properties

Compound Name3-ethyl-N-(1-pyridin-4-ylethyl)piperidine-3-carboxamide
PubChem CID63130581
Molecular FormulaC15H23N3O
Molecular Weight261.37 g/mol
Exact Mass261.18
IUPAC Name3-ethyl-N-(1-pyridin-4-ylethyl)piperidine-3-carboxamide
SMILESCCC1(C(=O)NC(C)c2ccncc2)CCCNC1
InChIInChI=1S/C15H23N3O/c1-3-15(7-4-8-17-11-15)14(19)18-12(2)13-5-9-16-10-6-13/h5-6,9-10,12,17H,3-4,7-8,11H2,1-2H3,(H,18,19)
InChIKeyPOPVPNYYMZCBER-UHFFFAOYSA-N
XLogP2.04
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 52.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-ethyl-N-(1-phenylethyl)piperidine-3-carboxamide
CID 63132202
3-ethyl-N-[(1R)-1-pyridin-2-ylethyl]piperidine-3-carboxamide
CID 81407453
3-ethyl-N-[(1S)-1-pyridin-3-ylethyl]pyrrolidine-3-carboxamide
CID 81404117
1-(aminomethyl)-N-[(1R)-1-pyridin-4-ylethyl]cyclopentane-1-carboxamide
CID 94008169
N-[(1R)-1-(4-chlorophenyl)ethyl]-3-ethylpyrrolidine-3-carboxamide
CID 81354852
N-[1-(2-bromophenyl)ethyl]-3-ethylpiperidine-3-carboxamide
CID 63130128
N-[1-(4-ethoxyphenyl)ethyl]-3-ethylpyrrolidine-3-carboxamide
CID 63139806
3-ethyl-N-(2-methyl-1-thiophen-2-ylpropyl)piperidine-3-carboxamide
CID 63130877
3-ethyl-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]piperidine-3-carboxamide
CID 106388269
3-ethyl-N-[1-(4-methyl-1,2,4-triazol-3-yl)ethyl]piperidine-3-carboxamide
CID 63130828
2-[1-[(3-ethylpiperidine-3-carbonyl)amino]ethyl]-1,3-thiazole-4-carboxylic acid
CID 66379247
2-methyl-N-[(1S)-1-pyridin-4-ylethyl]pyrrolidine-2-carboxamide
CID 81410580

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-N-(1-pyridin-4-ylethyl)piperidine-3-carboxamide?
The IUPAC name of 3-ethyl-N-(1-pyridin-4-ylethyl)piperidine-3-carboxamide (CID 63130581) is 3-ethyl-N-(1-pyridin-4-ylethyl)piperidine-3-carboxamide.
What is the SMILES notation for 3-ethyl-N-(1-pyridin-4-ylethyl)piperidine-3-carboxamide?
The canonical SMILES for 3-ethyl-N-(1-pyridin-4-ylethyl)piperidine-3-carboxamide is CCC1(C(=O)NC(C)c2ccncc2)CCCNC1.
What is the InChIKey of 3-ethyl-N-(1-pyridin-4-ylethyl)piperidine-3-carboxamide?
The InChIKey is POPVPNYYMZCBER-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O/c1-3-15(7-4-8-17-11-15)14(19)18-12(2)13-5-9-16-10-6-13/h5-6,9-10,12,17H,3-4,7-8,11H2,1-2H3,(H,18,19).
What are the key properties of 3-ethyl-N-(1-pyridin-4-ylethyl)piperidine-3-carboxamide?
3-ethyl-N-(1-pyridin-4-ylethyl)piperidine-3-carboxamide has a molecular weight of 261.37 g/mol, XLogP of 2.04, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-N-(1-pyridin-4-ylethyl)piperidine-3-carboxamide is sourced from PubChem (CID 63130581), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).