3-methyl-N-(2-methylpiperidin-4-yl)pyridine-2-carboxamide

C13H19N3O — CID 106995373

IUPAC3-methyl-N-(2-methylpiperidin-4-yl)pyridine-2-carboxamide
SMILESCc1cccnc1C(=O)NC1CCNC(C)C1
InChIInChI=1S/C13H19N3O/c1-9-4-3-6-15-12(9)13(17)16-11-5-7-14-10(2)8-11/h3-4,6,10-11,14H,5,7-8H2,1-2H3,(H,16,17)
InChIKeyXHJLUYJEFAYWOU-UHFFFAOYSA-N
MW233.31 g/mol
LogP1.26
Rot. Bonds2

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

3-methyl-N-(2-methylpiperidin-4-yl)pyridine-2-carboxamide (PubChem CID 106995373) has the molecular formula C13H19N3O and a molecular weight of 233.31 g/mol. Its IUPAC name is 3-methyl-N-(2-methylpiperidin-4-yl)pyridine-2-carboxamide.

Molecular Properties

Compound Name3-methyl-N-(2-methylpiperidin-4-yl)pyridine-2-carboxamide
PubChem CID106995373
Molecular FormulaC13H19N3O
Molecular Weight233.31 g/mol
Exact Mass233.15
IUPAC Name3-methyl-N-(2-methylpiperidin-4-yl)pyridine-2-carboxamide
SMILESCc1cccnc1C(=O)NC1CCNC(C)C1
InChIInChI=1S/C13H19N3O/c1-9-4-3-6-15-12(9)13(17)16-11-5-7-14-10(2)8-11/h3-4,6,10-11,14H,5,7-8H2,1-2H3,(H,16,17)
InChIKeyXHJLUYJEFAYWOU-UHFFFAOYSA-N
XLogP1.26
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.31
LogP ≤ 51.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-(2-methylpiperidin-4-yl)pyridine-2-carboxamide?
The IUPAC name of 3-methyl-N-(2-methylpiperidin-4-yl)pyridine-2-carboxamide (CID 106995373) is 3-methyl-N-(2-methylpiperidin-4-yl)pyridine-2-carboxamide.
What is the SMILES notation for 3-methyl-N-(2-methylpiperidin-4-yl)pyridine-2-carboxamide?
The canonical SMILES for 3-methyl-N-(2-methylpiperidin-4-yl)pyridine-2-carboxamide is Cc1cccnc1C(=O)NC1CCNC(C)C1.
What is the InChIKey of 3-methyl-N-(2-methylpiperidin-4-yl)pyridine-2-carboxamide?
The InChIKey is XHJLUYJEFAYWOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O/c1-9-4-3-6-15-12(9)13(17)16-11-5-7-14-10(2)8-11/h3-4,6,10-11,14H,5,7-8H2,1-2H3,(H,16,17).
What are the key properties of 3-methyl-N-(2-methylpiperidin-4-yl)pyridine-2-carboxamide?
3-methyl-N-(2-methylpiperidin-4-yl)pyridine-2-carboxamide has a molecular weight of 233.31 g/mol, XLogP of 1.26, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-(2-methylpiperidin-4-yl)pyridine-2-carboxamide is sourced from PubChem (CID 106995373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).