N-[(4-methyl-3-pyridinyl)methyl]piperidine-3-carboxamide

C13H19N3O — CID 114956004

IUPACN-[(4-methyl-3-pyridinyl)methyl]piperidine-3-carboxamide
SMILESCc1ccncc1CNC(=O)C1CCCNC1
InChIInChI=1S/C13H19N3O/c1-10-4-6-15-8-12(10)9-16-13(17)11-3-2-5-14-7-11/h4,6,8,11,14H,2-3,5,7,9H2,1H3,(H,16,17)
InChIKeyIHBVDZMEBKFMJL-UHFFFAOYSA-N
MW233.31 g/mol
LogP1.01
Rot. Bonds3

About N-[(4-methyl-3-pyridinyl)methyl]piperidine-3-carboxamide

N-[(4-methyl-3-pyridinyl)methyl]piperidine-3-carboxamide (PubChem CID 114956004) has the molecular formula C13H19N3O and a molecular weight of 233.31 g/mol. Its IUPAC name is N-[(4-methyl-3-pyridinyl)methyl]piperidine-3-carboxamide.

Molecular Properties

Compound NameN-[(4-methyl-3-pyridinyl)methyl]piperidine-3-carboxamide
PubChem CID114956004
Molecular FormulaC13H19N3O
Molecular Weight233.31 g/mol
Exact Mass233.15
IUPAC NameN-[(4-methyl-3-pyridinyl)methyl]piperidine-3-carboxamide
SMILESCc1ccncc1CNC(=O)C1CCCNC1
InChIInChI=1S/C13H19N3O/c1-10-4-6-15-8-12(10)9-16-13(17)11-3-2-5-14-7-11/h4,6,8,11,14H,2-3,5,7,9H2,1H3,(H,16,17)
InChIKeyIHBVDZMEBKFMJL-UHFFFAOYSA-N
XLogP1.01
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.31
LogP ≤ 51.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(pyridin-4-ylmethyl)piperidine-3-carboxamide;hydrochloride
CID 56832251
N-[(2,3-dimethylphenyl)methyl]piperidine-3-carboxamide;hydrochloride
CID 66770651
(3S)-N-[(6-methyl-3-pyridinyl)methyl]piperidine-3-carboxamide
CID 81140194
N-[(4-methylphenyl)methyl]piperidine-3-carboxamide
CID 18073073
N-[(1,3-dimethylpyrazol-4-yl)methyl]piperidine-3-carboxamide
CID 112669514
N-[(4-methyl-3-pyridinyl)methyl]piperidine-3-sulfonamide
CID 114956767
(3S)-N-[[2-(hydroxymethyl)phenyl]methyl]piperidine-3-carboxamide
CID 124591380
2-[2-[[[(3R)-piperidine-3-carbonyl]amino]methyl]phenyl]acetic acid
CID 81317773
(3S)-N-[(2-methoxy-3-pyridinyl)methyl]piperidine-3-carboxamide
CID 81124657
(3S)-N-[(2,5-dimethoxyphenyl)methyl]piperidine-3-carboxamide
CID 81140138
(3R)-N-[(3-ethyl-2-pyridinyl)methyl]piperidine-3-carboxamide
CID 82737771
(3S)-N-[(2-bromophenyl)methyl]piperidine-3-carboxamide
CID 81141738

Frequently Asked Questions

What is the IUPAC name of N-[(4-methyl-3-pyridinyl)methyl]piperidine-3-carboxamide?
The IUPAC name of N-[(4-methyl-3-pyridinyl)methyl]piperidine-3-carboxamide (CID 114956004) is N-[(4-methyl-3-pyridinyl)methyl]piperidine-3-carboxamide.
What is the SMILES notation for N-[(4-methyl-3-pyridinyl)methyl]piperidine-3-carboxamide?
The canonical SMILES for N-[(4-methyl-3-pyridinyl)methyl]piperidine-3-carboxamide is Cc1ccncc1CNC(=O)C1CCCNC1.
What is the InChIKey of N-[(4-methyl-3-pyridinyl)methyl]piperidine-3-carboxamide?
The InChIKey is IHBVDZMEBKFMJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O/c1-10-4-6-15-8-12(10)9-16-13(17)11-3-2-5-14-7-11/h4,6,8,11,14H,2-3,5,7,9H2,1H3,(H,16,17).
What are the key properties of N-[(4-methyl-3-pyridinyl)methyl]piperidine-3-carboxamide?
N-[(4-methyl-3-pyridinyl)methyl]piperidine-3-carboxamide has a molecular weight of 233.31 g/mol, XLogP of 1.01, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-methyl-3-pyridinyl)methyl]piperidine-3-carboxamide is sourced from PubChem (CID 114956004), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).