2-methyl-N-(3-methyl-1,3-thiazol-2-ylidene)benzamide

C12H12N2OS — CID 3710007

IUPAC2-methyl-N-(3-methyl-1,3-thiazol-2-ylidene)benzamide
SMILESCc1ccccc1C(=O)/N=c1/sccn1C
InChIInChI=1S/C12H12N2OS/c1-9-5-3-4-6-10(9)11(15)13-12-14(2)7-8-16-12/h3-8H,1-2H3/b13-12+
InChIKeyWBNLCFOVCGUFTD-OUKQBFOZSA-N
MW232.31 g/mol
LogP2.14
Rot. Bonds1

About 2-methyl-N-(3-methyl-1,3-thiazol-2-ylidene)benzamide

2-methyl-N-(3-methyl-1,3-thiazol-2-ylidene)benzamide (PubChem CID 3710007) has the molecular formula C12H12N2OS and a molecular weight of 232.31 g/mol. Its IUPAC name is 2-methyl-N-(3-methyl-1,3-thiazol-2-ylidene)benzamide.

Molecular Properties

Compound Name2-methyl-N-(3-methyl-1,3-thiazol-2-ylidene)benzamide
PubChem CID3710007
Molecular FormulaC12H12N2OS
Molecular Weight232.31 g/mol
Exact Mass232.07
IUPAC Name2-methyl-N-(3-methyl-1,3-thiazol-2-ylidene)benzamide
SMILESCc1ccccc1C(=O)/N=c1/sccn1C
InChIInChI=1S/C12H12N2OS/c1-9-5-3-4-6-10(9)11(15)13-12-14(2)7-8-16-12/h3-8H,1-2H3/b13-12+
InChIKeyWBNLCFOVCGUFTD-OUKQBFOZSA-N
XLogP2.14
TPSA34.36 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.31
LogP ≤ 52.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 2-methyl-N-(3-methyl-1,3-thiazol-2-ylidene)benzamide 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 2-methyl-N-(3-methyl-1,3-thiazol-2-ylidene)benzamide?
The IUPAC name of 2-methyl-N-(3-methyl-1,3-thiazol-2-ylidene)benzamide (CID 3710007) is 2-methyl-N-(3-methyl-1,3-thiazol-2-ylidene)benzamide.
What is the SMILES notation for 2-methyl-N-(3-methyl-1,3-thiazol-2-ylidene)benzamide?
The canonical SMILES for 2-methyl-N-(3-methyl-1,3-thiazol-2-ylidene)benzamide is Cc1ccccc1C(=O)/N=c1/sccn1C.
What is the InChIKey of 2-methyl-N-(3-methyl-1,3-thiazol-2-ylidene)benzamide?
The InChIKey is WBNLCFOVCGUFTD-OUKQBFOZSA-N. The full InChI is InChI=1S/C12H12N2OS/c1-9-5-3-4-6-10(9)11(15)13-12-14(2)7-8-16-12/h3-8H,1-2H3/b13-12+.
What are the key properties of 2-methyl-N-(3-methyl-1,3-thiazol-2-ylidene)benzamide?
2-methyl-N-(3-methyl-1,3-thiazol-2-ylidene)benzamide has a molecular weight of 232.31 g/mol, XLogP of 2.14, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(3-methyl-1,3-thiazol-2-ylidene)benzamide is sourced from PubChem (CID 3710007), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).