N-methyl-1-(pyridine-3-carbonyl)-N-(pyridin-2-ylmethyl)piperidine-2-carboxamide

C19H22N4O2 — CID 71998761

IUPACN-methyl-1-(pyridine-3-carbonyl)-N-(pyridin-2-ylmethyl)piperidine-2-carboxamide
SMILESCN(Cc1ccccn1)C(=O)C1CCCCN1C(=O)c1cccnc1
InChIInChI=1S/C19H22N4O2/c1-22(14-16-8-2-4-11-21-16)19(25)17-9-3-5-12-23(17)18(24)15-7-6-10-20-13-15/h2,4,6-8,10-11,13,17H,3,5,9,12,14H2,1H3
InChIKeyDTUZSHGCRZNMCR-UHFFFAOYSA-N
MW338.41 g/mol
LogP2.13
Rot. Bonds4

About N-methyl-1-(pyridine-3-carbonyl)-N-(pyridin-2-ylmethyl)piperidine-2-carboxamide

N-methyl-1-(pyridine-3-carbonyl)-N-(pyridin-2-ylmethyl)piperidine-2-carboxamide (PubChem CID 71998761) has the molecular formula C19H22N4O2 and a molecular weight of 338.41 g/mol. Its IUPAC name is N-methyl-1-(pyridine-3-carbonyl)-N-(pyridin-2-ylmethyl)piperidine-2-carboxamide.

Molecular Properties

Compound NameN-methyl-1-(pyridine-3-carbonyl)-N-(pyridin-2-ylmethyl)piperidine-2-carboxamide
PubChem CID71998761
Molecular FormulaC19H22N4O2
Molecular Weight338.41 g/mol
Exact Mass338.17
IUPAC NameN-methyl-1-(pyridine-3-carbonyl)-N-(pyridin-2-ylmethyl)piperidine-2-carboxamide
SMILESCN(Cc1ccccn1)C(=O)C1CCCCN1C(=O)c1cccnc1
InChIInChI=1S/C19H22N4O2/c1-22(14-16-8-2-4-11-21-16)19(25)17-9-3-5-12-23(17)18(24)15-7-6-10-20-13-15/h2,4,6-8,10-11,13,17H,3,5,9,12,14H2,1H3
InChIKeyDTUZSHGCRZNMCR-UHFFFAOYSA-N
XLogP2.13
TPSA66.40 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.41
LogP ≤ 52.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N-methyl-N-(4-phenylphenyl)-1-(pyridine-3-carbonyl)piperidine-2-carboxamide
CID 167991863
N-methyl-N-(4-methylphenyl)-1-(pyridine-3-carbonyl)piperidine-2-carboxamide
CID 166214456
methyl 1-(pyridine-3-carbonyl)piperidine-2-carboxylate
CID 115280040
(4-methylpiperidin-1-yl)-[1-(pyridine-3-carbonyl)piperidin-2-yl]methanone
CID 119032862
1-benzoyl-N-(2-hydroxyethyl)-N-methylpiperidine-2-carboxamide
CID 110887525
[(3aS,6aR)-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl]-[(2R)-1-(pyridine-3-carbonyl)piperidin-2-yl]methanone
CID 97078426
[2-(2-hydroxypropyl)piperidin-1-yl]-pyridin-3-ylmethanone
CID 79549270
1-[1-(pyridine-3-carbonyl)piperidin-2-yl]propan-2-one
CID 79548958
1-[(4aR,9aR)-1-(pyridine-3-carbonyl)-3,4,4a,6,7,8,9,9a-octahydro-2H-pyrido[3,2-b]azepin-5-yl]ethanone
CID 110145133
N-methyl-N-(pyridin-2-ylmethyl)pyrrolidine-1-carboxamide
CID 115590459
tert-butyl (2S)-1-(pyridine-3-carbonyl)pyrrolidine-2-carboxylate
CID 10564407
[(2R)-2-[(1R)-1-aminoethyl]piperidin-1-yl]-pyridin-3-ylmethanone
CID 95038925

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(pyridine-3-carbonyl)-N-(pyridin-2-ylmethyl)piperidine-2-carboxamide?
The IUPAC name of N-methyl-1-(pyridine-3-carbonyl)-N-(pyridin-2-ylmethyl)piperidine-2-carboxamide (CID 71998761) is N-methyl-1-(pyridine-3-carbonyl)-N-(pyridin-2-ylmethyl)piperidine-2-carboxamide.
What is the SMILES notation for N-methyl-1-(pyridine-3-carbonyl)-N-(pyridin-2-ylmethyl)piperidine-2-carboxamide?
The canonical SMILES for N-methyl-1-(pyridine-3-carbonyl)-N-(pyridin-2-ylmethyl)piperidine-2-carboxamide is CN(Cc1ccccn1)C(=O)C1CCCCN1C(=O)c1cccnc1.
What is the InChIKey of N-methyl-1-(pyridine-3-carbonyl)-N-(pyridin-2-ylmethyl)piperidine-2-carboxamide?
The InChIKey is DTUZSHGCRZNMCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N4O2/c1-22(14-16-8-2-4-11-21-16)19(25)17-9-3-5-12-23(17)18(24)15-7-6-10-20-13-15/h2,4,6-8,10-11,13,17H,3,5,9,12,14H2,1H3.
What are the key properties of N-methyl-1-(pyridine-3-carbonyl)-N-(pyridin-2-ylmethyl)piperidine-2-carboxamide?
N-methyl-1-(pyridine-3-carbonyl)-N-(pyridin-2-ylmethyl)piperidine-2-carboxamide has a molecular weight of 338.41 g/mol, XLogP of 2.13, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(pyridine-3-carbonyl)-N-(pyridin-2-ylmethyl)piperidine-2-carboxamide is sourced from PubChem (CID 71998761), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).