6-amino-N-(2,4-dimethyl-3-pyridinyl)pyridine-3-carboxamide

C13H14N4O — CID 112741980

IUPAC6-amino-N-(2,4-dimethyl-3-pyridinyl)pyridine-3-carboxamide
SMILESCc1ccnc(C)c1NC(=O)c1ccc(N)nc1
InChIInChI=1S/C13H14N4O/c1-8-5-6-15-9(2)12(8)17-13(18)10-3-4-11(14)16-7-10/h3-7H,1-2H3,(H2,14,16)(H,17,18)
InChIKeyBAPXLTPEGBZPRG-UHFFFAOYSA-N
MW242.28 g/mol
LogP1.93
Rot. Bonds2

About 6-amino-N-(2,4-dimethyl-3-pyridinyl)pyridine-3-carboxamide

6-amino-N-(2,4-dimethyl-3-pyridinyl)pyridine-3-carboxamide (PubChem CID 112741980) has the molecular formula C13H14N4O and a molecular weight of 242.28 g/mol. Its IUPAC name is 6-amino-N-(2,4-dimethyl-3-pyridinyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name6-amino-N-(2,4-dimethyl-3-pyridinyl)pyridine-3-carboxamide
PubChem CID112741980
Molecular FormulaC13H14N4O
Molecular Weight242.28 g/mol
Exact Mass242.12
IUPAC Name6-amino-N-(2,4-dimethyl-3-pyridinyl)pyridine-3-carboxamide
SMILESCc1ccnc(C)c1NC(=O)c1ccc(N)nc1
InChIInChI=1S/C13H14N4O/c1-8-5-6-15-9(2)12(8)17-13(18)10-3-4-11(14)16-7-10/h3-7H,1-2H3,(H2,14,16)(H,17,18)
InChIKeyBAPXLTPEGBZPRG-UHFFFAOYSA-N
XLogP1.93
TPSA80.90 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.28
LogP ≤ 51.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 6-amino-N-(2,4-dimethyl-3-pyridinyl)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 6-amino-N-(2,4-dimethyl-3-pyridinyl)pyridine-3-carboxamide?
The IUPAC name of 6-amino-N-(2,4-dimethyl-3-pyridinyl)pyridine-3-carboxamide (CID 112741980) is 6-amino-N-(2,4-dimethyl-3-pyridinyl)pyridine-3-carboxamide.
What is the SMILES notation for 6-amino-N-(2,4-dimethyl-3-pyridinyl)pyridine-3-carboxamide?
The canonical SMILES for 6-amino-N-(2,4-dimethyl-3-pyridinyl)pyridine-3-carboxamide is Cc1ccnc(C)c1NC(=O)c1ccc(N)nc1.
What is the InChIKey of 6-amino-N-(2,4-dimethyl-3-pyridinyl)pyridine-3-carboxamide?
The InChIKey is BAPXLTPEGBZPRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N4O/c1-8-5-6-15-9(2)12(8)17-13(18)10-3-4-11(14)16-7-10/h3-7H,1-2H3,(H2,14,16)(H,17,18).
What are the key properties of 6-amino-N-(2,4-dimethyl-3-pyridinyl)pyridine-3-carboxamide?
6-amino-N-(2,4-dimethyl-3-pyridinyl)pyridine-3-carboxamide has a molecular weight of 242.28 g/mol, XLogP of 1.93, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-N-(2,4-dimethyl-3-pyridinyl)pyridine-3-carboxamide is sourced from PubChem (CID 112741980), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).