4,6-dimethyl-2-[(4-methyl-1,3-thiazol-2-yl)amino]pyridine-3-carbonitrile

C12H12N4S — CID 61175143

IUPAC4,6-dimethyl-2-[(4-methyl-1,3-thiazol-2-yl)amino]pyridine-3-carbonitrile
SMILESCc1csc(Nc2nc(C)cc(C)c2C#N)n1
InChIInChI=1S/C12H12N4S/c1-7-4-8(2)14-11(10(7)5-13)16-12-15-9(3)6-17-12/h4,6H,1-3H3,(H,14,15,16)
InChIKeyWKPCYKMOBMUTMO-UHFFFAOYSA-N
MW244.32 g/mol
LogP3.08
Rot. Bonds2

About 4,6-dimethyl-2-[(4-methyl-1,3-thiazol-2-yl)amino]pyridine-3-carbonitrile

4,6-dimethyl-2-[(4-methyl-1,3-thiazol-2-yl)amino]pyridine-3-carbonitrile (PubChem CID 61175143) has the molecular formula C12H12N4S and a molecular weight of 244.32 g/mol. Its IUPAC name is 4,6-dimethyl-2-[(4-methyl-1,3-thiazol-2-yl)amino]pyridine-3-carbonitrile.

Molecular Properties

Compound Name4,6-dimethyl-2-[(4-methyl-1,3-thiazol-2-yl)amino]pyridine-3-carbonitrile
PubChem CID61175143
Molecular FormulaC12H12N4S
Molecular Weight244.32 g/mol
Exact Mass244.08
IUPAC Name4,6-dimethyl-2-[(4-methyl-1,3-thiazol-2-yl)amino]pyridine-3-carbonitrile
SMILESCc1csc(Nc2nc(C)cc(C)c2C#N)n1
InChIInChI=1S/C12H12N4S/c1-7-4-8(2)14-11(10(7)5-13)16-12-15-9(3)6-17-12/h4,6H,1-3H3,(H,14,15,16)
InChIKeyWKPCYKMOBMUTMO-UHFFFAOYSA-N
XLogP3.08
TPSA61.60 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.32
LogP ≤ 53.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 4,6-dimethyl-2-[(4-methyl-1,3-thiazol-2-yl)amino]pyridine-3-carbonitrile with MolForge

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

Launch Full Analysis

Related Compounds

(3-cyano-4,6-dimethyl-2-pyridinyl)cyanamide
CID 11008385
4,6-dimethyl-2-[(4-methyl-1,3-thiazol-2-yl)methylamino]pyridine-3-carbonitrile
CID 55026390
2-(3,5-dichloroanilino)-4,6-dimethylpyridine-3-carbonitrile
CID 784964
2-(4-fluoroanilino)-4,6-dimethylpyridine-3-carbonitrile
CID 706821
5,6-diethyl-3-[(4-methyl-1,3-thiazol-2-yl)amino]pyridazine-4-carbonitrile
CID 80509164
4,6-dimethyl-2-(4-methylsulfonylanilino)pyridine-3-carbonitrile
CID 61175342
2-(3-chloro-4-methylanilino)-4,6-dimethylpyridine-3-carbonitrile
CID 55195359
4,6-dimethyl-2-(4-propan-2-ylanilino)pyridine-3-carbonitrile
CID 60710577
2-(2,4-dimethylanilino)-4,6-dimethylpyridine-3-carbonitrile
CID 750176
2-(2-cyano-3-methylanilino)-4,6-dimethylpyridine-3-carbonitrile
CID 107805421
2-(3-iodoanilino)-4,6-dimethylpyridine-3-carbonitrile
CID 63511438
4,6-dimethyl-2-(3-propan-2-ylanilino)pyridine-3-carbonitrile
CID 63510093

Frequently Asked Questions

What is the IUPAC name of 4,6-dimethyl-2-[(4-methyl-1,3-thiazol-2-yl)amino]pyridine-3-carbonitrile?
The IUPAC name of 4,6-dimethyl-2-[(4-methyl-1,3-thiazol-2-yl)amino]pyridine-3-carbonitrile (CID 61175143) is 4,6-dimethyl-2-[(4-methyl-1,3-thiazol-2-yl)amino]pyridine-3-carbonitrile.
What is the SMILES notation for 4,6-dimethyl-2-[(4-methyl-1,3-thiazol-2-yl)amino]pyridine-3-carbonitrile?
The canonical SMILES for 4,6-dimethyl-2-[(4-methyl-1,3-thiazol-2-yl)amino]pyridine-3-carbonitrile is Cc1csc(Nc2nc(C)cc(C)c2C#N)n1.
What is the InChIKey of 4,6-dimethyl-2-[(4-methyl-1,3-thiazol-2-yl)amino]pyridine-3-carbonitrile?
The InChIKey is WKPCYKMOBMUTMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N4S/c1-7-4-8(2)14-11(10(7)5-13)16-12-15-9(3)6-17-12/h4,6H,1-3H3,(H,14,15,16).
What are the key properties of 4,6-dimethyl-2-[(4-methyl-1,3-thiazol-2-yl)amino]pyridine-3-carbonitrile?
4,6-dimethyl-2-[(4-methyl-1,3-thiazol-2-yl)amino]pyridine-3-carbonitrile has a molecular weight of 244.32 g/mol, XLogP of 3.08, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4,6-dimethyl-2-[(4-methyl-1,3-thiazol-2-yl)amino]pyridine-3-carbonitrile is sourced from PubChem (CID 61175143), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).