2-amino-N-ethyl-1,3-thiazole-4-carboxamide

C6H9N3OS — CID 42281847

IUPAC2-amino-N-ethyl-1,3-thiazole-4-carboxamide
SMILESCCNC(=O)c1csc(N)n1
InChIInChI=1S/C6H9N3OS/c1-2-8-5(10)4-3-11-6(7)9-4/h3H,2H2,1H3,(H2,7,9)(H,8,10)
InChIKeyZLCICGBDZSRXJW-UHFFFAOYSA-N
MW171.23 g/mol
LogP0.47
Rot. Bonds2

About 2-amino-N-ethyl-1,3-thiazole-4-carboxamide

2-amino-N-ethyl-1,3-thiazole-4-carboxamide (PubChem CID 42281847) has the molecular formula C6H9N3OS and a molecular weight of 171.23 g/mol. Its IUPAC name is 2-amino-N-ethyl-1,3-thiazole-4-carboxamide.

Molecular Properties

Compound Name2-amino-N-ethyl-1,3-thiazole-4-carboxamide
PubChem CID42281847
Molecular FormulaC6H9N3OS
Molecular Weight171.23 g/mol
Exact Mass171.05
IUPAC Name2-amino-N-ethyl-1,3-thiazole-4-carboxamide
SMILESCCNC(=O)c1csc(N)n1
InChIInChI=1S/C6H9N3OS/c1-2-8-5(10)4-3-11-6(7)9-4/h3H,2H2,1H3,(H2,7,9)(H,8,10)
InChIKeyZLCICGBDZSRXJW-UHFFFAOYSA-N
XLogP0.47
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.23
LogP ≤ 50.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-amino-N-ethyl-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-amino-N-ethyl-1,3-thiazole-4-carboxamide?
The IUPAC name of 2-amino-N-ethyl-1,3-thiazole-4-carboxamide (CID 42281847) is 2-amino-N-ethyl-1,3-thiazole-4-carboxamide.
What is the SMILES notation for 2-amino-N-ethyl-1,3-thiazole-4-carboxamide?
The canonical SMILES for 2-amino-N-ethyl-1,3-thiazole-4-carboxamide is CCNC(=O)c1csc(N)n1.
What is the InChIKey of 2-amino-N-ethyl-1,3-thiazole-4-carboxamide?
The InChIKey is ZLCICGBDZSRXJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9N3OS/c1-2-8-5(10)4-3-11-6(7)9-4/h3H,2H2,1H3,(H2,7,9)(H,8,10).
What are the key properties of 2-amino-N-ethyl-1,3-thiazole-4-carboxamide?
2-amino-N-ethyl-1,3-thiazole-4-carboxamide has a molecular weight of 171.23 g/mol, XLogP of 0.47, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-ethyl-1,3-thiazole-4-carboxamide is sourced from PubChem (CID 42281847), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).