2,6-dimethyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyridine-4-carboxamide

C17H27N3O — CID 134505652

IUPAC2,6-dimethyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyridine-4-carboxamide
SMILESCc1cc(C(=O)NC2(C)CCN(C(C)C)CC2)cc(C)n1
InChIInChI=1S/C17H27N3O/c1-12(2)20-8-6-17(5,7-9-20)19-16(21)15-10-13(3)18-14(4)11-15/h10-12H,6-9H2,1-5H3,(H,19,21)
InChIKeyFVFFIJLXZNQTPQ-UHFFFAOYSA-N
MW289.42 g/mol
LogP2.69
Rot. Bonds3

About 2,6-dimethyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyridine-4-carboxamide

2,6-dimethyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyridine-4-carboxamide (PubChem CID 134505652) has the molecular formula C17H27N3O and a molecular weight of 289.42 g/mol. Its IUPAC name is 2,6-dimethyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyridine-4-carboxamide.

Molecular Properties

Compound Name2,6-dimethyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyridine-4-carboxamide
PubChem CID134505652
Molecular FormulaC17H27N3O
Molecular Weight289.42 g/mol
Exact Mass289.22
IUPAC Name2,6-dimethyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyridine-4-carboxamide
SMILESCc1cc(C(=O)NC2(C)CCN(C(C)C)CC2)cc(C)n1
InChIInChI=1S/C17H27N3O/c1-12(2)20-8-6-17(5,7-9-20)19-16(21)15-10-13(3)18-14(4)11-15/h10-12H,6-9H2,1-5H3,(H,19,21)
InChIKeyFVFFIJLXZNQTPQ-UHFFFAOYSA-N
XLogP2.69
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.42
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2,6-dimethyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyridine-4-carboxamide?
The IUPAC name of 2,6-dimethyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyridine-4-carboxamide (CID 134505652) is 2,6-dimethyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyridine-4-carboxamide.
What is the SMILES notation for 2,6-dimethyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyridine-4-carboxamide?
The canonical SMILES for 2,6-dimethyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyridine-4-carboxamide is Cc1cc(C(=O)NC2(C)CCN(C(C)C)CC2)cc(C)n1.
What is the InChIKey of 2,6-dimethyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyridine-4-carboxamide?
The InChIKey is FVFFIJLXZNQTPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27N3O/c1-12(2)20-8-6-17(5,7-9-20)19-16(21)15-10-13(3)18-14(4)11-15/h10-12H,6-9H2,1-5H3,(H,19,21).
What are the key properties of 2,6-dimethyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyridine-4-carboxamide?
2,6-dimethyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyridine-4-carboxamide has a molecular weight of 289.42 g/mol, XLogP of 2.69, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dimethyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyridine-4-carboxamide is sourced from PubChem (CID 134505652), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).