N-(2-amino-2-oxoethyl)-1,3-thiazole-4-carboxamide

C6H7N3O2S — CID 63037740

IUPACN-(2-amino-2-oxoethyl)-1,3-thiazole-4-carboxamide
SMILESNC(=O)CNC(=O)c1cscn1
InChIInChI=1S/C6H7N3O2S/c7-5(10)1-8-6(11)4-2-12-3-9-4/h2-3H,1H2,(H2,7,10)(H,8,11)
InChIKeyUYYGLQFHURBWIW-UHFFFAOYSA-N
MW185.21 g/mol
LogP-0.64
Rot. Bonds3

About N-(2-amino-2-oxoethyl)-1,3-thiazole-4-carboxamide

N-(2-amino-2-oxoethyl)-1,3-thiazole-4-carboxamide (PubChem CID 63037740) has the molecular formula C6H7N3O2S and a molecular weight of 185.21 g/mol. Its IUPAC name is N-(2-amino-2-oxoethyl)-1,3-thiazole-4-carboxamide.

Molecular Properties

Compound NameN-(2-amino-2-oxoethyl)-1,3-thiazole-4-carboxamide
PubChem CID63037740
Molecular FormulaC6H7N3O2S
Molecular Weight185.21 g/mol
Exact Mass185.03
IUPAC NameN-(2-amino-2-oxoethyl)-1,3-thiazole-4-carboxamide
SMILESNC(=O)CNC(=O)c1cscn1
InChIInChI=1S/C6H7N3O2S/c7-5(10)1-8-6(11)4-2-12-3-9-4/h2-3H,1H2,(H2,7,10)(H,8,11)
InChIKeyUYYGLQFHURBWIW-UHFFFAOYSA-N
XLogP-0.64
TPSA85.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.21
LogP ≤ 5-0.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-(2-amino-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 N-(2-amino-2-oxoethyl)-1,3-thiazole-4-carboxamide?
The IUPAC name of N-(2-amino-2-oxoethyl)-1,3-thiazole-4-carboxamide (CID 63037740) is N-(2-amino-2-oxoethyl)-1,3-thiazole-4-carboxamide.
What is the SMILES notation for N-(2-amino-2-oxoethyl)-1,3-thiazole-4-carboxamide?
The canonical SMILES for N-(2-amino-2-oxoethyl)-1,3-thiazole-4-carboxamide is NC(=O)CNC(=O)c1cscn1.
What is the InChIKey of N-(2-amino-2-oxoethyl)-1,3-thiazole-4-carboxamide?
The InChIKey is UYYGLQFHURBWIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7N3O2S/c7-5(10)1-8-6(11)4-2-12-3-9-4/h2-3H,1H2,(H2,7,10)(H,8,11).
What are the key properties of N-(2-amino-2-oxoethyl)-1,3-thiazole-4-carboxamide?
N-(2-amino-2-oxoethyl)-1,3-thiazole-4-carboxamide has a molecular weight of 185.21 g/mol, XLogP of -0.64, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-2-oxoethyl)-1,3-thiazole-4-carboxamide is sourced from PubChem (CID 63037740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).