3-methyl-N-[(3-methyl-2-pyridinyl)methyl]piperidine-2-carboxamide

C14H21N3O — CID 107068180

IUPAC3-methyl-N-[(3-methyl-2-pyridinyl)methyl]piperidine-2-carboxamide
SMILESCc1cccnc1CNC(=O)C1NCCCC1C
InChIInChI=1S/C14H21N3O/c1-10-5-3-7-15-12(10)9-17-14(18)13-11(2)6-4-8-16-13/h3,5,7,11,13,16H,4,6,8-9H2,1-2H3,(H,17,18)
InChIKeyJTAJEOJCHWUFFT-UHFFFAOYSA-N
MW247.34 g/mol
LogP1.39
Rot. Bonds3

About 3-methyl-N-[(3-methyl-2-pyridinyl)methyl]piperidine-2-carboxamide

3-methyl-N-[(3-methyl-2-pyridinyl)methyl]piperidine-2-carboxamide (PubChem CID 107068180) has the molecular formula C14H21N3O and a molecular weight of 247.34 g/mol. Its IUPAC name is 3-methyl-N-[(3-methyl-2-pyridinyl)methyl]piperidine-2-carboxamide.

Molecular Properties

Compound Name3-methyl-N-[(3-methyl-2-pyridinyl)methyl]piperidine-2-carboxamide
PubChem CID107068180
Molecular FormulaC14H21N3O
Molecular Weight247.34 g/mol
Exact Mass247.17
IUPAC Name3-methyl-N-[(3-methyl-2-pyridinyl)methyl]piperidine-2-carboxamide
SMILESCc1cccnc1CNC(=O)C1NCCCC1C
InChIInChI=1S/C14H21N3O/c1-10-5-3-7-15-12(10)9-17-14(18)13-11(2)6-4-8-16-13/h3,5,7,11,13,16H,4,6,8-9H2,1-2H3,(H,17,18)
InChIKeyJTAJEOJCHWUFFT-UHFFFAOYSA-N
XLogP1.39
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.34
LogP ≤ 51.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(3-methyl-2-pyridinyl)methyl]pyrrolidine-3-carboxamide;dihydrochloride
CID 119869411
5-[[(3-methylpiperidine-2-carbonyl)amino]methyl]pyridine-2-carboxylic acid
CID 107068397
4-[(3-methyl-2-pyridinyl)methylcarbamoyl]cyclohexane-1-carboxylic acid
CID 63784717
3-methyl-N-(8-methylquinolin-5-yl)piperidine-2-carboxamide
CID 107067502
2-amino-N-[(3-methyl-2-pyridinyl)methyl]cyclohexane-1-carboxamide
CID 64822512
4-hydroxy-N-[(3-methyl-2-pyridinyl)methyl]pyrrolidine-2-carboxamide
CID 63306283
N-[(1,5-dimethylpyrazol-4-yl)methyl]-3-methylpiperidine-2-carboxamide
CID 106047227
N-[(3-methyl-2-pyridinyl)methyl]-1,2,3,4-tetrahydroisoquinoline-1-carboxamide
CID 63306571
(2S)-N-[(3-methyl-2-pyridinyl)methyl]morpholine-2-carboxamide
CID 92632288
3-methyl-N-[(3-methyl-2-pyridinyl)methyl]piperidine-1-carboxamide
CID 113232203
N-[[3-(methoxymethyl)phenyl]methyl]-3-methylpiperidine-2-carboxamide
CID 107067835
trans-(1S,2S)-N-[(3-methyl-2-pyridinyl)methyl]-2-(pyrrolidine-1-carbonyl)cyclohexane-1-carboxamide
CID 96526857

Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-[(3-methyl-2-pyridinyl)methyl]piperidine-2-carboxamide?
The IUPAC name of 3-methyl-N-[(3-methyl-2-pyridinyl)methyl]piperidine-2-carboxamide (CID 107068180) is 3-methyl-N-[(3-methyl-2-pyridinyl)methyl]piperidine-2-carboxamide.
What is the SMILES notation for 3-methyl-N-[(3-methyl-2-pyridinyl)methyl]piperidine-2-carboxamide?
The canonical SMILES for 3-methyl-N-[(3-methyl-2-pyridinyl)methyl]piperidine-2-carboxamide is Cc1cccnc1CNC(=O)C1NCCCC1C.
What is the InChIKey of 3-methyl-N-[(3-methyl-2-pyridinyl)methyl]piperidine-2-carboxamide?
The InChIKey is JTAJEOJCHWUFFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O/c1-10-5-3-7-15-12(10)9-17-14(18)13-11(2)6-4-8-16-13/h3,5,7,11,13,16H,4,6,8-9H2,1-2H3,(H,17,18).
What are the key properties of 3-methyl-N-[(3-methyl-2-pyridinyl)methyl]piperidine-2-carboxamide?
3-methyl-N-[(3-methyl-2-pyridinyl)methyl]piperidine-2-carboxamide has a molecular weight of 247.34 g/mol, XLogP of 1.39, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-[(3-methyl-2-pyridinyl)methyl]piperidine-2-carboxamide is sourced from PubChem (CID 107068180), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).