2-methyl-N-[2-(methylamino)-2-oxoethyl]-1,3-thiazole-4-carboxamide

C8H11N3O2S — CID 47443639

IUPAC2-methyl-N-[2-(methylamino)-2-oxoethyl]-1,3-thiazole-4-carboxamide
SMILESCNC(=O)CNC(=O)c1csc(C)n1
InChIInChI=1S/C8H11N3O2S/c1-5-11-6(4-14-5)8(13)10-3-7(12)9-2/h4H,3H2,1-2H3,(H,9,12)(H,10,13)
InChIKeyKQEBSOWWGHZQJH-UHFFFAOYSA-N
MW213.26 g/mol
LogP-0.07
Rot. Bonds3

About 2-methyl-N-[2-(methylamino)-2-oxoethyl]-1,3-thiazole-4-carboxamide

2-methyl-N-[2-(methylamino)-2-oxoethyl]-1,3-thiazole-4-carboxamide (PubChem CID 47443639) has the molecular formula C8H11N3O2S and a molecular weight of 213.26 g/mol. Its IUPAC name is 2-methyl-N-[2-(methylamino)-2-oxoethyl]-1,3-thiazole-4-carboxamide.

Molecular Properties

Compound Name2-methyl-N-[2-(methylamino)-2-oxoethyl]-1,3-thiazole-4-carboxamide
PubChem CID47443639
Molecular FormulaC8H11N3O2S
Molecular Weight213.26 g/mol
Exact Mass213.06
IUPAC Name2-methyl-N-[2-(methylamino)-2-oxoethyl]-1,3-thiazole-4-carboxamide
SMILESCNC(=O)CNC(=O)c1csc(C)n1
InChIInChI=1S/C8H11N3O2S/c1-5-11-6(4-14-5)8(13)10-3-7(12)9-2/h4H,3H2,1-2H3,(H,9,12)(H,10,13)
InChIKeyKQEBSOWWGHZQJH-UHFFFAOYSA-N
XLogP-0.07
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.26
LogP ≤ 5-0.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-methyl-N-[2-(methylamino)-2-oxoethyl]-1,3-thiazole-4-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 2-methyl-N-[2-(methylamino)-2-oxoethyl]-1,3-thiazole-4-carboxamide?
The IUPAC name of 2-methyl-N-[2-(methylamino)-2-oxoethyl]-1,3-thiazole-4-carboxamide (CID 47443639) is 2-methyl-N-[2-(methylamino)-2-oxoethyl]-1,3-thiazole-4-carboxamide.
What is the SMILES notation for 2-methyl-N-[2-(methylamino)-2-oxoethyl]-1,3-thiazole-4-carboxamide?
The canonical SMILES for 2-methyl-N-[2-(methylamino)-2-oxoethyl]-1,3-thiazole-4-carboxamide is CNC(=O)CNC(=O)c1csc(C)n1.
What is the InChIKey of 2-methyl-N-[2-(methylamino)-2-oxoethyl]-1,3-thiazole-4-carboxamide?
The InChIKey is KQEBSOWWGHZQJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11N3O2S/c1-5-11-6(4-14-5)8(13)10-3-7(12)9-2/h4H,3H2,1-2H3,(H,9,12)(H,10,13).
What are the key properties of 2-methyl-N-[2-(methylamino)-2-oxoethyl]-1,3-thiazole-4-carboxamide?
2-methyl-N-[2-(methylamino)-2-oxoethyl]-1,3-thiazole-4-carboxamide has a molecular weight of 213.26 g/mol, XLogP of -0.07, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[2-(methylamino)-2-oxoethyl]-1,3-thiazole-4-carboxamide is sourced from PubChem (CID 47443639), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).