N,1,5-trimethyl-6-oxopyridine-3-carboxamide

C9H12N2O2 — CID 156716692

IUPACN,1,5-trimethyl-6-oxopyridine-3-carboxamide
SMILESCNC(=O)c1cc(C)c(=O)n(C)c1
InChIInChI=1S/C9H12N2O2/c1-6-4-7(8(12)10-2)5-11(3)9(6)13/h4-5H,1-3H3,(H,10,12)
InChIKeyDYEIUVZUMQKTFD-UHFFFAOYSA-N
MW180.21 g/mol
LogP0.05
Rot. Bonds1

About N,1,5-trimethyl-6-oxopyridine-3-carboxamide

N,1,5-trimethyl-6-oxopyridine-3-carboxamide (PubChem CID 156716692) has the molecular formula C9H12N2O2 and a molecular weight of 180.21 g/mol. Its IUPAC name is N,1,5-trimethyl-6-oxopyridine-3-carboxamide.

Molecular Properties

Compound NameN,1,5-trimethyl-6-oxopyridine-3-carboxamide
PubChem CID156716692
Molecular FormulaC9H12N2O2
Molecular Weight180.21 g/mol
Exact Mass180.09
IUPAC NameN,1,5-trimethyl-6-oxopyridine-3-carboxamide
SMILESCNC(=O)c1cc(C)c(=O)n(C)c1
InChIInChI=1S/C9H12N2O2/c1-6-4-7(8(12)10-2)5-11(3)9(6)13/h4-5H,1-3H3,(H,10,12)
InChIKeyDYEIUVZUMQKTFD-UHFFFAOYSA-N
XLogP0.05
TPSA51.10 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.21
LogP ≤ 50.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N,1,5-trimethyl-6-oxopyridine-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N,1,5-trimethyl-6-oxopyridine-3-carboxamide?
The IUPAC name of N,1,5-trimethyl-6-oxopyridine-3-carboxamide (CID 156716692) is N,1,5-trimethyl-6-oxopyridine-3-carboxamide.
What is the SMILES notation for N,1,5-trimethyl-6-oxopyridine-3-carboxamide?
The canonical SMILES for N,1,5-trimethyl-6-oxopyridine-3-carboxamide is CNC(=O)c1cc(C)c(=O)n(C)c1.
What is the InChIKey of N,1,5-trimethyl-6-oxopyridine-3-carboxamide?
The InChIKey is DYEIUVZUMQKTFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N2O2/c1-6-4-7(8(12)10-2)5-11(3)9(6)13/h4-5H,1-3H3,(H,10,12).
What are the key properties of N,1,5-trimethyl-6-oxopyridine-3-carboxamide?
N,1,5-trimethyl-6-oxopyridine-3-carboxamide has a molecular weight of 180.21 g/mol, XLogP of 0.05, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,1,5-trimethyl-6-oxopyridine-3-carboxamide is sourced from PubChem (CID 156716692), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).