3-ethyl-N-[(1R)-1-pyridin-2-ylethyl]piperidine-3-carboxamide

C15H23N3O — CID 81407453

IUPAC3-ethyl-N-[(1R)-1-pyridin-2-ylethyl]piperidine-3-carboxamide
SMILESCCC1(C(=O)N[C@H](C)c2ccccn2)CCCNC1
InChIInChI=1S/C15H23N3O/c1-3-15(8-6-9-16-11-15)14(19)18-12(2)13-7-4-5-10-17-13/h4-5,7,10,12,16H,3,6,8-9,11H2,1-2H3,(H,18,19)/t12-,15?/m1/s1
InChIKeyCXNPTNGKVRDTRV-KEKZHRQWSA-N
MW261.37 g/mol
LogP2.04
Rot. Bonds4

About 3-ethyl-N-[(1R)-1-pyridin-2-ylethyl]piperidine-3-carboxamide

3-ethyl-N-[(1R)-1-pyridin-2-ylethyl]piperidine-3-carboxamide (PubChem CID 81407453) has the molecular formula C15H23N3O and a molecular weight of 261.37 g/mol. Its IUPAC name is 3-ethyl-N-[(1R)-1-pyridin-2-ylethyl]piperidine-3-carboxamide.

Molecular Properties

Compound Name3-ethyl-N-[(1R)-1-pyridin-2-ylethyl]piperidine-3-carboxamide
PubChem CID81407453
Molecular FormulaC15H23N3O
Molecular Weight261.37 g/mol
Exact Mass261.18
IUPAC Name3-ethyl-N-[(1R)-1-pyridin-2-ylethyl]piperidine-3-carboxamide
SMILESCCC1(C(=O)N[C@H](C)c2ccccn2)CCCNC1
InChIInChI=1S/C15H23N3O/c1-3-15(8-6-9-16-11-15)14(19)18-12(2)13-7-4-5-10-17-13/h4-5,7,10,12,16H,3,6,8-9,11H2,1-2H3,(H,18,19)/t12-,15?/m1/s1
InChIKeyCXNPTNGKVRDTRV-KEKZHRQWSA-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
2-ethyl-N-[(1S)-1-pyridin-2-ylethyl]pyrrolidine-2-carboxamide
CID 83073993
3-ethyl-N-(1-pyridin-4-ylethyl)piperidine-3-carboxamide
CID 63130581
N-[1-(2-bromophenyl)ethyl]-3-ethylpiperidine-3-carboxamide
CID 63130128
3-ethyl-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]piperidine-3-carboxamide
CID 106388269
N-[(1R)-1-pyridin-2-ylethyl]-3-(trifluoromethyl)pyrrolidine-3-carboxamide
CID 81406521
2-[1-[(3-ethylpiperidine-3-carbonyl)amino]ethyl]-1,3-thiazole-4-carboxylic acid
CID 66379247
3-ethyl-N-(2-methyl-1-thiophen-2-ylpropyl)piperidine-3-carboxamide
CID 63130877
3-ethyl-N-[(1S)-1-pyridin-3-ylethyl]pyrrolidine-3-carboxamide
CID 81404117
3-ethyl-N-[1-(4-methyl-1,2,4-triazol-3-yl)ethyl]piperidine-3-carboxamide
CID 63130828
N-[1-(2-bromophenyl)ethyl]-3-ethylpyrrolidine-3-carboxamide
CID 63139495
1-amino-N-(1-pyridin-2-ylethyl)cyclobutane-1-carboxamide
CID 81179767

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-N-[(1R)-1-pyridin-2-ylethyl]piperidine-3-carboxamide?
The IUPAC name of 3-ethyl-N-[(1R)-1-pyridin-2-ylethyl]piperidine-3-carboxamide (CID 81407453) is 3-ethyl-N-[(1R)-1-pyridin-2-ylethyl]piperidine-3-carboxamide.
What is the SMILES notation for 3-ethyl-N-[(1R)-1-pyridin-2-ylethyl]piperidine-3-carboxamide?
The canonical SMILES for 3-ethyl-N-[(1R)-1-pyridin-2-ylethyl]piperidine-3-carboxamide is CCC1(C(=O)N[C@H](C)c2ccccn2)CCCNC1.
What is the InChIKey of 3-ethyl-N-[(1R)-1-pyridin-2-ylethyl]piperidine-3-carboxamide?
The InChIKey is CXNPTNGKVRDTRV-KEKZHRQWSA-N. The full InChI is InChI=1S/C15H23N3O/c1-3-15(8-6-9-16-11-15)14(19)18-12(2)13-7-4-5-10-17-13/h4-5,7,10,12,16H,3,6,8-9,11H2,1-2H3,(H,18,19)/t12-,15?/m1/s1.
What are the key properties of 3-ethyl-N-[(1R)-1-pyridin-2-ylethyl]piperidine-3-carboxamide?
3-ethyl-N-[(1R)-1-pyridin-2-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-[(1R)-1-pyridin-2-ylethyl]piperidine-3-carboxamide is sourced from PubChem (CID 81407453), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).