3-methyl-N-(2-pyridin-4-ylethyl)piperidine-1-carboxamide

C14H21N3O — CID 113258779

IUPAC3-methyl-N-(2-pyridin-4-ylethyl)piperidine-1-carboxamide
SMILESCC1CCCN(C(=O)NCCc2ccncc2)C1
InChIInChI=1S/C14H21N3O/c1-12-3-2-10-17(11-12)14(18)16-9-6-13-4-7-15-8-5-13/h4-5,7-8,12H,2-3,6,9-11H2,1H3,(H,16,18)
InChIKeyZWOANPRHJFHRRR-UHFFFAOYSA-N
MW247.34 g/mol
LogP2.07
Rot. Bonds3

About 3-methyl-N-(2-pyridin-4-ylethyl)piperidine-1-carboxamide

3-methyl-N-(2-pyridin-4-ylethyl)piperidine-1-carboxamide (PubChem CID 113258779) has the molecular formula C14H21N3O and a molecular weight of 247.34 g/mol. Its IUPAC name is 3-methyl-N-(2-pyridin-4-ylethyl)piperidine-1-carboxamide.

Molecular Properties

Compound Name3-methyl-N-(2-pyridin-4-ylethyl)piperidine-1-carboxamide
PubChem CID113258779
Molecular FormulaC14H21N3O
Molecular Weight247.34 g/mol
Exact Mass247.17
IUPAC Name3-methyl-N-(2-pyridin-4-ylethyl)piperidine-1-carboxamide
SMILESCC1CCCN(C(=O)NCCc2ccncc2)C1
InChIInChI=1S/C14H21N3O/c1-12-3-2-10-17(11-12)14(18)16-9-6-13-4-7-15-8-5-13/h4-5,7-8,12H,2-3,6,9-11H2,1H3,(H,16,18)
InChIKeyZWOANPRHJFHRRR-UHFFFAOYSA-N
XLogP2.07
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.34
LogP ≤ 52.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-(4-fluorophenyl)ethyl]-3-methylpiperidine-1-carboxamide
CID 108902116
N-(2-pyridin-4-ylethyl)piperidine-1-carboxamide
CID 113258758
(3aR,4R,7S,7aS)-N-(2-pyridin-4-ylethyl)-1,3,3a,4,5,6,7,7a-octahydro-4,7-epoxyisoindole-2-carboxamide
CID 155955584
2-[1-(2-pyridin-4-ylethylcarbamoyl)azetidin-3-yl]propanoic acid
CID 116682944
1-(3-methylpiperidin-1-yl)-3-[methyl(2-pyridin-4-ylethyl)amino]propan-1-one
CID 109026177
3-methyl-N-[2-(1-methyl-1,2,4-triazol-3-yl)ethyl]piperidine-1-carboxamide
CID 115688762
N-ethyl-3-methylpiperidine-1-carboxamide
CID 89048200
N-[2-(4-ethylphenyl)ethyl]-3-(hydroxymethyl)piperidine-1-carboxamide
CID 111435204
4-(3-methylpiperidine-1-carbonyl)-N-(2-phenylethyl)benzamide
CID 109047837
5-hydroxy-N-(2-pyridin-4-ylethyl)-1-oxa-9-azaspiro[5.5]undecane-9-carboxamide
CID 119066269
N-[2-[cyclopropyl(methyl)amino]ethyl]-3-methylpiperidine-1-carboxamide
CID 115623615
N-(2-phenylethyl)-3-pyrimidin-4-yloxypiperidine-1-carboxamide
CID 122161080

Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-(2-pyridin-4-ylethyl)piperidine-1-carboxamide?
The IUPAC name of 3-methyl-N-(2-pyridin-4-ylethyl)piperidine-1-carboxamide (CID 113258779) is 3-methyl-N-(2-pyridin-4-ylethyl)piperidine-1-carboxamide.
What is the SMILES notation for 3-methyl-N-(2-pyridin-4-ylethyl)piperidine-1-carboxamide?
The canonical SMILES for 3-methyl-N-(2-pyridin-4-ylethyl)piperidine-1-carboxamide is CC1CCCN(C(=O)NCCc2ccncc2)C1.
What is the InChIKey of 3-methyl-N-(2-pyridin-4-ylethyl)piperidine-1-carboxamide?
The InChIKey is ZWOANPRHJFHRRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O/c1-12-3-2-10-17(11-12)14(18)16-9-6-13-4-7-15-8-5-13/h4-5,7-8,12H,2-3,6,9-11H2,1H3,(H,16,18).
What are the key properties of 3-methyl-N-(2-pyridin-4-ylethyl)piperidine-1-carboxamide?
3-methyl-N-(2-pyridin-4-ylethyl)piperidine-1-carboxamide has a molecular weight of 247.34 g/mol, XLogP of 2.07, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-(2-pyridin-4-ylethyl)piperidine-1-carboxamide is sourced from PubChem (CID 113258779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).