N-methyl-1-pyridin-2-ylpiperidine-3-carboxamide

C12H17N3O — CID 133270598

IUPACN-methyl-1-pyridin-2-ylpiperidine-3-carboxamide
SMILESCNC(=O)C1CCCN(c2ccccn2)C1
InChIInChI=1S/C12H17N3O/c1-13-12(16)10-5-4-8-15(9-10)11-6-2-3-7-14-11/h2-3,6-7,10H,4-5,8-9H2,1H3,(H,13,16)
InChIKeyZQBLUSIXOGDNPH-UHFFFAOYSA-N
MW219.29 g/mol
LogP1.04
Rot. Bonds2

About N-methyl-1-pyridin-2-ylpiperidine-3-carboxamide

N-methyl-1-pyridin-2-ylpiperidine-3-carboxamide (PubChem CID 133270598) has the molecular formula C12H17N3O and a molecular weight of 219.29 g/mol. Its IUPAC name is N-methyl-1-pyridin-2-ylpiperidine-3-carboxamide.

Molecular Properties

Compound NameN-methyl-1-pyridin-2-ylpiperidine-3-carboxamide
PubChem CID133270598
Molecular FormulaC12H17N3O
Molecular Weight219.29 g/mol
Exact Mass219.14
IUPAC NameN-methyl-1-pyridin-2-ylpiperidine-3-carboxamide
SMILESCNC(=O)C1CCCN(c2ccccn2)C1
InChIInChI=1S/C12H17N3O/c1-13-12(16)10-5-4-8-15(9-10)11-6-2-3-7-14-11/h2-3,6-7,10H,4-5,8-9H2,1H3,(H,13,16)
InChIKeyZQBLUSIXOGDNPH-UHFFFAOYSA-N
XLogP1.04
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.29
LogP ≤ 51.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

methyl (3S)-1-pyridin-2-ylpiperidine-3-carboxylate
CID 133326705
N-methyl-1-pyridazin-3-ylpiperidine-3-carboxamide
CID 110269425
(3R)-N-(3,5-dimethylphenyl)-1-pyridin-2-ylpiperidine-3-carboxamide
CID 51962224
(3S)-N-(1-ethylpiperidin-4-yl)-1-pyridin-2-ylpiperidine-3-carboxamide
CID 94824323
(3S)-N-[2-[(3R)-3-methylpiperidin-1-yl]ethyl]-1-pyridin-2-ylpiperidine-3-carboxamide
CID 124839677
(3R)-N-[1-(methoxymethyl)cyclopentyl]-1-pyridin-2-ylpiperidine-3-carboxamide
CID 95204110
N-[1-ethyl-4-(methylcarbamoyl)pyrazol-5-yl]-1-pyridin-2-ylpiperidine-3-carboxamide
CID 155909318
1-[5-(1-hydroxyethyl)-2-pyridinyl]-N-methylpiperidine-3-carboxamide
CID 103196725
1-[5-(aminomethyl)-2-pyridinyl]-N-methylpiperidine-3-carboxamide
CID 103194591
(3S)-N-[2-(3,5-dimethylpyrazol-1-yl)ethyl]-1-pyridin-2-ylpiperidine-3-carboxamide
CID 99957148
(3R)-N-[2-(3,5-dimethylpyrazol-1-yl)ethyl]-1-pyridin-2-ylpiperidine-3-carboxamide
CID 99957145
1-(2-aminophenyl)-N-methylpiperidine-3-carboxamide
CID 103194310

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-pyridin-2-ylpiperidine-3-carboxamide?
The IUPAC name of N-methyl-1-pyridin-2-ylpiperidine-3-carboxamide (CID 133270598) is N-methyl-1-pyridin-2-ylpiperidine-3-carboxamide.
What is the SMILES notation for N-methyl-1-pyridin-2-ylpiperidine-3-carboxamide?
The canonical SMILES for N-methyl-1-pyridin-2-ylpiperidine-3-carboxamide is CNC(=O)C1CCCN(c2ccccn2)C1.
What is the InChIKey of N-methyl-1-pyridin-2-ylpiperidine-3-carboxamide?
The InChIKey is ZQBLUSIXOGDNPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N3O/c1-13-12(16)10-5-4-8-15(9-10)11-6-2-3-7-14-11/h2-3,6-7,10H,4-5,8-9H2,1H3,(H,13,16).
What are the key properties of N-methyl-1-pyridin-2-ylpiperidine-3-carboxamide?
N-methyl-1-pyridin-2-ylpiperidine-3-carboxamide has a molecular weight of 219.29 g/mol, XLogP of 1.04, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-pyridin-2-ylpiperidine-3-carboxamide is sourced from PubChem (CID 133270598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).