2-methyl-6-(3-methylpiperidin-1-yl)pyridine-4-carboxamide

C13H19N3O — CID 90718373

IUPAC2-methyl-6-(3-methylpiperidin-1-yl)pyridine-4-carboxamide
SMILESCc1cc(C(N)=O)cc(N2CCCC(C)C2)n1
InChIInChI=1S/C13H19N3O/c1-9-4-3-5-16(8-9)12-7-11(13(14)17)6-10(2)15-12/h6-7,9H,3-5,8H2,1-2H3,(H2,14,17)
InChIKeyPDLPBYGYGBCFPP-UHFFFAOYSA-N
MW233.31 g/mol
LogP1.73
Rot. Bonds2

About 2-methyl-6-(3-methylpiperidin-1-yl)pyridine-4-carboxamide

2-methyl-6-(3-methylpiperidin-1-yl)pyridine-4-carboxamide (PubChem CID 90718373) has the molecular formula C13H19N3O and a molecular weight of 233.31 g/mol. Its IUPAC name is 2-methyl-6-(3-methylpiperidin-1-yl)pyridine-4-carboxamide.

Molecular Properties

Compound Name2-methyl-6-(3-methylpiperidin-1-yl)pyridine-4-carboxamide
PubChem CID90718373
Molecular FormulaC13H19N3O
Molecular Weight233.31 g/mol
Exact Mass233.15
IUPAC Name2-methyl-6-(3-methylpiperidin-1-yl)pyridine-4-carboxamide
SMILESCc1cc(C(N)=O)cc(N2CCCC(C)C2)n1
InChIInChI=1S/C13H19N3O/c1-9-4-3-5-16(8-9)12-7-11(13(14)17)6-10(2)15-12/h6-7,9H,3-5,8H2,1-2H3,(H2,14,17)
InChIKeyPDLPBYGYGBCFPP-UHFFFAOYSA-N
XLogP1.73
TPSA59.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.31
LogP ≤ 51.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-6-(3-methylpiperidin-1-yl)pyridine-4-carboxamide?
The IUPAC name of 2-methyl-6-(3-methylpiperidin-1-yl)pyridine-4-carboxamide (CID 90718373) is 2-methyl-6-(3-methylpiperidin-1-yl)pyridine-4-carboxamide.
What is the SMILES notation for 2-methyl-6-(3-methylpiperidin-1-yl)pyridine-4-carboxamide?
The canonical SMILES for 2-methyl-6-(3-methylpiperidin-1-yl)pyridine-4-carboxamide is Cc1cc(C(N)=O)cc(N2CCCC(C)C2)n1.
What is the InChIKey of 2-methyl-6-(3-methylpiperidin-1-yl)pyridine-4-carboxamide?
The InChIKey is PDLPBYGYGBCFPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O/c1-9-4-3-5-16(8-9)12-7-11(13(14)17)6-10(2)15-12/h6-7,9H,3-5,8H2,1-2H3,(H2,14,17).
What are the key properties of 2-methyl-6-(3-methylpiperidin-1-yl)pyridine-4-carboxamide?
2-methyl-6-(3-methylpiperidin-1-yl)pyridine-4-carboxamide has a molecular weight of 233.31 g/mol, XLogP of 1.73, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-6-(3-methylpiperidin-1-yl)pyridine-4-carboxamide is sourced from PubChem (CID 90718373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).