N-methyl-2-[2-(3-methylpiperidin-1-yl)propylamino]pyridine-3-carboxamide

C16H26N4O — CID 133328259

IUPACN-methyl-2-[2-(3-methylpiperidin-1-yl)propylamino]pyridine-3-carboxamide
SMILESCNC(=O)c1cccnc1NCC(C)N1CCCC(C)C1
InChIInChI=1S/C16H26N4O/c1-12-6-5-9-20(11-12)13(2)10-19-15-14(16(21)17-3)7-4-8-18-15/h4,7-8,12-13H,5-6,9-11H2,1-3H3,(H,17,21)(H,18,19)
InChIKeyQPDYUJMDDPFTNZ-UHFFFAOYSA-N
MW290.41 g/mol
LogP1.97
Rot. Bonds5

About N-methyl-2-[2-(3-methylpiperidin-1-yl)propylamino]pyridine-3-carboxamide

N-methyl-2-[2-(3-methylpiperidin-1-yl)propylamino]pyridine-3-carboxamide (PubChem CID 133328259) has the molecular formula C16H26N4O and a molecular weight of 290.41 g/mol. Its IUPAC name is N-methyl-2-[2-(3-methylpiperidin-1-yl)propylamino]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-methyl-2-[2-(3-methylpiperidin-1-yl)propylamino]pyridine-3-carboxamide
PubChem CID133328259
Molecular FormulaC16H26N4O
Molecular Weight290.41 g/mol
Exact Mass290.21
IUPAC NameN-methyl-2-[2-(3-methylpiperidin-1-yl)propylamino]pyridine-3-carboxamide
SMILESCNC(=O)c1cccnc1NCC(C)N1CCCC(C)C1
InChIInChI=1S/C16H26N4O/c1-12-6-5-9-20(11-12)13(2)10-19-15-14(16(21)17-3)7-4-8-18-15/h4,7-8,12-13H,5-6,9-11H2,1-3H3,(H,17,21)(H,18,19)
InChIKeyQPDYUJMDDPFTNZ-UHFFFAOYSA-N
XLogP1.97
TPSA57.26 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 51.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

[2-[2-(3-methylpiperidin-1-yl)propylamino]-3-pyridinyl]-piperidin-1-ylmethanone
CID 133328244
2-[[2-(2-methoxyphenyl)-2-piperidin-1-ylethyl]amino]-N-methylpyridine-3-carboxamide
CID 133319504
2-bromo-N-[2-(3-methylpiperidin-1-yl)propyl]benzamide
CID 47036181
2-amino-N-[2-(3-methylpiperidin-1-yl)propyl]benzamide;dihydrochloride
CID 119946563
(3-methylpiperidin-1-yl)-[2-(propylamino)-3-pyridinyl]methanone
CID 62172051
[2-(methylamino)-3-pyridinyl]-(3-methylpiperidin-1-yl)methanone
CID 62172050
2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-N-[(2R)-2-[(3S)-3-methylpiperidin-1-yl]propyl]pyridine-3-carboxamide
CID 51953591
2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-N-[(2S)-2-[(3R)-3-methylpiperidin-1-yl]propyl]pyridine-3-carboxamide
CID 99845318
N-[(2R)-2-[(3R)-3-methylpiperidin-1-yl]propyl]pyrazine-2-carboxamide
CID 98720786
2-[(2-hydroxycyclopentyl)methylamino]-N-methylpyridine-3-carboxamide
CID 133324096
N-(4-bromophenyl)-2-[2-(4-methylpiperazin-1-yl)propylamino]pyridine-3-carboxamide
CID 133301482
2-[[2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-2-phenylethyl]amino]-N-methylpyridine-3-carboxamide
CID 133316958

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-[2-(3-methylpiperidin-1-yl)propylamino]pyridine-3-carboxamide?
The IUPAC name of N-methyl-2-[2-(3-methylpiperidin-1-yl)propylamino]pyridine-3-carboxamide (CID 133328259) is N-methyl-2-[2-(3-methylpiperidin-1-yl)propylamino]pyridine-3-carboxamide.
What is the SMILES notation for N-methyl-2-[2-(3-methylpiperidin-1-yl)propylamino]pyridine-3-carboxamide?
The canonical SMILES for N-methyl-2-[2-(3-methylpiperidin-1-yl)propylamino]pyridine-3-carboxamide is CNC(=O)c1cccnc1NCC(C)N1CCCC(C)C1.
What is the InChIKey of N-methyl-2-[2-(3-methylpiperidin-1-yl)propylamino]pyridine-3-carboxamide?
The InChIKey is QPDYUJMDDPFTNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N4O/c1-12-6-5-9-20(11-12)13(2)10-19-15-14(16(21)17-3)7-4-8-18-15/h4,7-8,12-13H,5-6,9-11H2,1-3H3,(H,17,21)(H,18,19).
What are the key properties of N-methyl-2-[2-(3-methylpiperidin-1-yl)propylamino]pyridine-3-carboxamide?
N-methyl-2-[2-(3-methylpiperidin-1-yl)propylamino]pyridine-3-carboxamide has a molecular weight of 290.41 g/mol, XLogP of 1.97, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-[2-(3-methylpiperidin-1-yl)propylamino]pyridine-3-carboxamide is sourced from PubChem (CID 133328259), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).