N-methyl-4,6-bis(methylamino)pyridine-3-carboxamide

C9H14N4O — CID 118473539

IUPACN-methyl-4,6-bis(methylamino)pyridine-3-carboxamide
SMILESCNC(=O)c1cnc(NC)cc1NC
InChIInChI=1S/C9H14N4O/c1-10-7-4-8(11-2)13-5-6(7)9(14)12-3/h4-5H,1-3H3,(H,12,14)(H2,10,11,13)
InChIKeyCDYIVYZUGDVONA-UHFFFAOYSA-N
MW194.24 g/mol
LogP0.52
Rot. Bonds3

About N-methyl-4,6-bis(methylamino)pyridine-3-carboxamide

N-methyl-4,6-bis(methylamino)pyridine-3-carboxamide (PubChem CID 118473539) has the molecular formula C9H14N4O and a molecular weight of 194.24 g/mol. Its IUPAC name is N-methyl-4,6-bis(methylamino)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-methyl-4,6-bis(methylamino)pyridine-3-carboxamide
PubChem CID118473539
Molecular FormulaC9H14N4O
Molecular Weight194.24 g/mol
Exact Mass194.12
IUPAC NameN-methyl-4,6-bis(methylamino)pyridine-3-carboxamide
SMILESCNC(=O)c1cnc(NC)cc1NC
InChIInChI=1S/C9H14N4O/c1-10-7-4-8(11-2)13-5-6(7)9(14)12-3/h4-5H,1-3H3,(H,12,14)(H2,10,11,13)
InChIKeyCDYIVYZUGDVONA-UHFFFAOYSA-N
XLogP0.52
TPSA66.05 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.24
LogP ≤ 50.52
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze N-methyl-4,6-bis(methylamino)pyridine-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-methyl-4,6-bis(methylamino)pyridine-3-carboxamide?
The IUPAC name of N-methyl-4,6-bis(methylamino)pyridine-3-carboxamide (CID 118473539) is N-methyl-4,6-bis(methylamino)pyridine-3-carboxamide.
What is the SMILES notation for N-methyl-4,6-bis(methylamino)pyridine-3-carboxamide?
The canonical SMILES for N-methyl-4,6-bis(methylamino)pyridine-3-carboxamide is CNC(=O)c1cnc(NC)cc1NC.
What is the InChIKey of N-methyl-4,6-bis(methylamino)pyridine-3-carboxamide?
The InChIKey is CDYIVYZUGDVONA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N4O/c1-10-7-4-8(11-2)13-5-6(7)9(14)12-3/h4-5H,1-3H3,(H,12,14)(H2,10,11,13).
What are the key properties of N-methyl-4,6-bis(methylamino)pyridine-3-carboxamide?
N-methyl-4,6-bis(methylamino)pyridine-3-carboxamide has a molecular weight of 194.24 g/mol, XLogP of 0.52, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-4,6-bis(methylamino)pyridine-3-carboxamide is sourced from PubChem (CID 118473539), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).