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

C12H17N3O — CID 63670702

IUPACN-(3-methyl-4-pyridinyl)piperidine-4-carboxamide
SMILESCc1cnccc1NC(=O)C1CCNCC1
InChIInChI=1S/C12H17N3O/c1-9-8-14-7-4-11(9)15-12(16)10-2-5-13-6-3-10/h4,7-8,10,13H,2-3,5-6H2,1H3,(H,14,15,16)
InChIKeyCTJXRDNJOFPMOC-UHFFFAOYSA-N
MW219.29 g/mol
LogP1.33
Rot. Bonds2

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

N-(3-methyl-4-pyridinyl)piperidine-4-carboxamide (PubChem CID 63670702) has the molecular formula C12H17N3O and a molecular weight of 219.29 g/mol. Its IUPAC name is N-(3-methyl-4-pyridinyl)piperidine-4-carboxamide.

Molecular Properties

Compound NameN-(3-methyl-4-pyridinyl)piperidine-4-carboxamide
PubChem CID63670702
Molecular FormulaC12H17N3O
Molecular Weight219.29 g/mol
Exact Mass219.14
IUPAC NameN-(3-methyl-4-pyridinyl)piperidine-4-carboxamide
SMILESCc1cnccc1NC(=O)C1CCNCC1
InChIInChI=1S/C12H17N3O/c1-9-8-14-7-4-11(9)15-12(16)10-2-5-13-6-3-10/h4,7-8,10,13H,2-3,5-6H2,1H3,(H,14,15,16)
InChIKeyCTJXRDNJOFPMOC-UHFFFAOYSA-N
XLogP1.33
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.29
LogP ≤ 51.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-methyl-4-pyridinyl)-2-piperidin-4-ylacetamide
CID 119876314
3-methyl-N-(3-methyl-4-pyridinyl)pyrrolidine-2-carboxamide
CID 102779456
N-(2,5-dimethylphenyl)piperidine-4-carboxamide
CID 18073176
N-(4-phenoxy-3-pyridinyl)piperidine-4-carboxamide
CID 119866026
N-(4-carbamoyl-2-methylphenyl)piperidine-4-carboxamide
CID 43706641
N-(6-chloro-4-methyl-3-pyridinyl)piperidine-4-carboxamide
CID 113264161
N-(3-methyl-4-pyridinyl)thiomorpholine-3-carboxamide
CID 82918036
N-pyrazin-2-ylpiperidine-4-carboxamide
CID 43616167
N-(2,3-dimethylphenyl)piperidine-4-carboxamide;hydrochloride
CID 119261898
N-[5-(2,2-dimethylpropanoylamino)-2-methylphenyl]piperidine-4-carboxamide
CID 119321946
(3R)-N-(2-methylphenyl)pyrrolidine-3-carboxamide
CID 94915623
N-(5-carbamoyl-2-methylphenyl)piperidine-4-carboxamide
CID 110471858

Frequently Asked Questions

What is the IUPAC name of N-(3-methyl-4-pyridinyl)piperidine-4-carboxamide?
The IUPAC name of N-(3-methyl-4-pyridinyl)piperidine-4-carboxamide (CID 63670702) is N-(3-methyl-4-pyridinyl)piperidine-4-carboxamide.
What is the SMILES notation for N-(3-methyl-4-pyridinyl)piperidine-4-carboxamide?
The canonical SMILES for N-(3-methyl-4-pyridinyl)piperidine-4-carboxamide is Cc1cnccc1NC(=O)C1CCNCC1.
What is the InChIKey of N-(3-methyl-4-pyridinyl)piperidine-4-carboxamide?
The InChIKey is CTJXRDNJOFPMOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N3O/c1-9-8-14-7-4-11(9)15-12(16)10-2-5-13-6-3-10/h4,7-8,10,13H,2-3,5-6H2,1H3,(H,14,15,16).
What are the key properties of N-(3-methyl-4-pyridinyl)piperidine-4-carboxamide?
N-(3-methyl-4-pyridinyl)piperidine-4-carboxamide has a molecular weight of 219.29 g/mol, XLogP of 1.33, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methyl-4-pyridinyl)piperidine-4-carboxamide is sourced from PubChem (CID 63670702), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).