2-(2-amino-1,3-thiazol-4-yl)-N-methylacetamide

C6H9N3OS — CID 42281839

IUPAC2-(2-amino-1,3-thiazol-4-yl)-N-methylacetamide
SMILESCNC(=O)Cc1csc(N)n1
InChIInChI=1S/C6H9N3OS/c1-8-5(10)2-4-3-11-6(7)9-4/h3H,2H2,1H3,(H2,7,9)(H,8,10)
InChIKeyIAAODOJFVLUMHE-UHFFFAOYSA-N
MW171.22 g/mol
LogP0.01
Rot. Bonds2

About 2-(2-amino-1,3-thiazol-4-yl)-N-methylacetamide

2-(2-amino-1,3-thiazol-4-yl)-N-methylacetamide (PubChem CID 42281839) has the molecular formula C6H9N3OS and a molecular weight of 171.22 g/mol. Its IUPAC name is 2-(2-amino-1,3-thiazol-4-yl)-N-methylacetamide.

Molecular Properties

Compound Name2-(2-amino-1,3-thiazol-4-yl)-N-methylacetamide
PubChem CID42281839
Molecular FormulaC6H9N3OS
Molecular Weight171.22 g/mol
Exact Mass171.05
IUPAC Name2-(2-amino-1,3-thiazol-4-yl)-N-methylacetamide
SMILESCNC(=O)Cc1csc(N)n1
InChIInChI=1S/C6H9N3OS/c1-8-5(10)2-4-3-11-6(7)9-4/h3H,2H2,1H3,(H2,7,9)(H,8,10)
InChIKeyIAAODOJFVLUMHE-UHFFFAOYSA-N
XLogP0.01
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.22
LogP ≤ 50.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-(2-amino-1,3-thiazol-4-yl)-N-methylacetamide 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-(2-amino-1,3-thiazol-4-yl)-N-methylacetamide?
The IUPAC name of 2-(2-amino-1,3-thiazol-4-yl)-N-methylacetamide (CID 42281839) is 2-(2-amino-1,3-thiazol-4-yl)-N-methylacetamide.
What is the SMILES notation for 2-(2-amino-1,3-thiazol-4-yl)-N-methylacetamide?
The canonical SMILES for 2-(2-amino-1,3-thiazol-4-yl)-N-methylacetamide is CNC(=O)Cc1csc(N)n1.
What is the InChIKey of 2-(2-amino-1,3-thiazol-4-yl)-N-methylacetamide?
The InChIKey is IAAODOJFVLUMHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9N3OS/c1-8-5(10)2-4-3-11-6(7)9-4/h3H,2H2,1H3,(H2,7,9)(H,8,10).
What are the key properties of 2-(2-amino-1,3-thiazol-4-yl)-N-methylacetamide?
2-(2-amino-1,3-thiazol-4-yl)-N-methylacetamide has a molecular weight of 171.22 g/mol, XLogP of 0.01, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-amino-1,3-thiazol-4-yl)-N-methylacetamide is sourced from PubChem (CID 42281839), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).