N-methyl-2-(4-pyridin-4-ylpiperidin-1-yl)pyridine-3-carboxamide

C17H20N4O — CID 155950461

IUPACN-methyl-2-(4-pyridin-4-ylpiperidin-1-yl)pyridine-3-carboxamide
SMILESCNC(=O)c1cccnc1N1CCC(c2ccncc2)CC1
InChIInChI=1S/C17H20N4O/c1-18-17(22)15-3-2-8-20-16(15)21-11-6-14(7-12-21)13-4-9-19-10-5-13/h2-5,8-10,14H,6-7,11-12H2,1H3,(H,18,22)
InChIKeyYRCXQHCVYHIXSK-UHFFFAOYSA-N
MW296.37 g/mol
LogP2.22
Rot. Bonds3

About N-methyl-2-(4-pyridin-4-ylpiperidin-1-yl)pyridine-3-carboxamide

N-methyl-2-(4-pyridin-4-ylpiperidin-1-yl)pyridine-3-carboxamide (PubChem CID 155950461) has the molecular formula C17H20N4O and a molecular weight of 296.37 g/mol. Its IUPAC name is N-methyl-2-(4-pyridin-4-ylpiperidin-1-yl)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-methyl-2-(4-pyridin-4-ylpiperidin-1-yl)pyridine-3-carboxamide
PubChem CID155950461
Molecular FormulaC17H20N4O
Molecular Weight296.37 g/mol
Exact Mass296.16
IUPAC NameN-methyl-2-(4-pyridin-4-ylpiperidin-1-yl)pyridine-3-carboxamide
SMILESCNC(=O)c1cccnc1N1CCC(c2ccncc2)CC1
InChIInChI=1S/C17H20N4O/c1-18-17(22)15-3-2-8-20-16(15)21-11-6-14(7-12-21)13-4-9-19-10-5-13/h2-5,8-10,14H,6-7,11-12H2,1H3,(H,18,22)
InChIKeyYRCXQHCVYHIXSK-UHFFFAOYSA-N
XLogP2.22
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.37
LogP ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(3S,4R)-1-[3-(methylcarbamoyl)-2-pyridinyl]-4-pyridin-4-ylpyrrolidine-3-carboxylic acid
CID 70714830
N-methyl-2-[3-(methylcarbamoyl)pyrrolidin-1-yl]pyridine-3-carboxamide
CID 135095238
N-methyl-2-[4-(1H-pyrrolo[2,3-b]pyridin-3-yl)piperidin-1-yl]pyridine-3-carboxamide
CID 155946909
2-[4-(1H-indol-3-yl)piperidin-1-yl]-N-methylpyridine-3-carboxamide
CID 155948642
2-[(1S,2S,6R,7R)-4-azatricyclo[5.2.1.02,6]decan-4-yl]-N-methylpyridine-3-carboxamide
CID 56901128
N-methyl-2-[4-(7-methyl-1,3-benzoxazol-2-yl)piperidin-1-yl]pyridine-3-carboxamide
CID 166233118
2-(2,3-dimethylpyrrolidin-1-yl)-N-methylpyridine-3-carboxamide
CID 133357626
2-[3-(1-hydroxyethyl)piperidin-1-yl]-N-methylpyridine-3-carboxamide
CID 133397673
2-[3-(4-ethylpiperazin-1-yl)pyrrolidin-1-yl]-N-methylpyridine-3-carboxamide
CID 133320439
N-methyl-2-[4-[4-(2-methylpropyl)benzoyl]piperidin-1-yl]pyridine-3-carboxamide
CID 133316798
piperidin-1-yl-[2-(3-pyridin-4-ylazetidin-1-yl)-3-pyridinyl]methanone
CID 56865869
N-methyl-2-[4-[5-(trifluoromethyl)-1,3-benzothiazol-2-yl]piperidin-1-yl]pyridine-3-carboxamide
CID 155948675

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-(4-pyridin-4-ylpiperidin-1-yl)pyridine-3-carboxamide?
The IUPAC name of N-methyl-2-(4-pyridin-4-ylpiperidin-1-yl)pyridine-3-carboxamide (CID 155950461) is N-methyl-2-(4-pyridin-4-ylpiperidin-1-yl)pyridine-3-carboxamide.
What is the SMILES notation for N-methyl-2-(4-pyridin-4-ylpiperidin-1-yl)pyridine-3-carboxamide?
The canonical SMILES for N-methyl-2-(4-pyridin-4-ylpiperidin-1-yl)pyridine-3-carboxamide is CNC(=O)c1cccnc1N1CCC(c2ccncc2)CC1.
What is the InChIKey of N-methyl-2-(4-pyridin-4-ylpiperidin-1-yl)pyridine-3-carboxamide?
The InChIKey is YRCXQHCVYHIXSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N4O/c1-18-17(22)15-3-2-8-20-16(15)21-11-6-14(7-12-21)13-4-9-19-10-5-13/h2-5,8-10,14H,6-7,11-12H2,1H3,(H,18,22).
What are the key properties of N-methyl-2-(4-pyridin-4-ylpiperidin-1-yl)pyridine-3-carboxamide?
N-methyl-2-(4-pyridin-4-ylpiperidin-1-yl)pyridine-3-carboxamide has a molecular weight of 296.37 g/mol, XLogP of 2.22, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-(4-pyridin-4-ylpiperidin-1-yl)pyridine-3-carboxamide is sourced from PubChem (CID 155950461), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).