5-cyano-6-methyl-N-(1,3-thiazol-2-yl)pyridine-2-carboxamide

C11H8N4OS — CID 39088130

IUPAC5-cyano-6-methyl-N-(1,3-thiazol-2-yl)pyridine-2-carboxamide
SMILESCc1nc(C(=O)Nc2nccs2)ccc1C#N
InChIInChI=1S/C11H8N4OS/c1-7-8(6-12)2-3-9(14-7)10(16)15-11-13-4-5-17-11/h2-5H,1H3,(H,13,15,16)
InChIKeyAWCJCYQKXQIZSS-UHFFFAOYSA-N
MW244.28 g/mol
LogP1.97
Rot. Bonds2

About 5-cyano-6-methyl-N-(1,3-thiazol-2-yl)pyridine-2-carboxamide

5-cyano-6-methyl-N-(1,3-thiazol-2-yl)pyridine-2-carboxamide (PubChem CID 39088130) has the molecular formula C11H8N4OS and a molecular weight of 244.28 g/mol. Its IUPAC name is 5-cyano-6-methyl-N-(1,3-thiazol-2-yl)pyridine-2-carboxamide.

Molecular Properties

Compound Name5-cyano-6-methyl-N-(1,3-thiazol-2-yl)pyridine-2-carboxamide
PubChem CID39088130
Molecular FormulaC11H8N4OS
Molecular Weight244.28 g/mol
Exact Mass244.04
IUPAC Name5-cyano-6-methyl-N-(1,3-thiazol-2-yl)pyridine-2-carboxamide
SMILESCc1nc(C(=O)Nc2nccs2)ccc1C#N
InChIInChI=1S/C11H8N4OS/c1-7-8(6-12)2-3-9(14-7)10(16)15-11-13-4-5-17-11/h2-5H,1H3,(H,13,15,16)
InChIKeyAWCJCYQKXQIZSS-UHFFFAOYSA-N
XLogP1.97
TPSA78.67 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.28
LogP ≤ 51.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-cyano-6-methyl-N-(1,3-thiazol-2-yl)pyridine-2-carboxamide?
The IUPAC name of 5-cyano-6-methyl-N-(1,3-thiazol-2-yl)pyridine-2-carboxamide (CID 39088130) is 5-cyano-6-methyl-N-(1,3-thiazol-2-yl)pyridine-2-carboxamide.
What is the SMILES notation for 5-cyano-6-methyl-N-(1,3-thiazol-2-yl)pyridine-2-carboxamide?
The canonical SMILES for 5-cyano-6-methyl-N-(1,3-thiazol-2-yl)pyridine-2-carboxamide is Cc1nc(C(=O)Nc2nccs2)ccc1C#N.
What is the InChIKey of 5-cyano-6-methyl-N-(1,3-thiazol-2-yl)pyridine-2-carboxamide?
The InChIKey is AWCJCYQKXQIZSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8N4OS/c1-7-8(6-12)2-3-9(14-7)10(16)15-11-13-4-5-17-11/h2-5H,1H3,(H,13,15,16).
What are the key properties of 5-cyano-6-methyl-N-(1,3-thiazol-2-yl)pyridine-2-carboxamide?
5-cyano-6-methyl-N-(1,3-thiazol-2-yl)pyridine-2-carboxamide has a molecular weight of 244.28 g/mol, XLogP of 1.97, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyano-6-methyl-N-(1,3-thiazol-2-yl)pyridine-2-carboxamide is sourced from PubChem (CID 39088130), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).