2-[(4-chloro-1,3-thiazol-2-yl)amino]propanamide

C6H8ClN3OS — CID 83152052

IUPAC2-[(4-chloro-1,3-thiazol-2-yl)amino]propanamide
SMILESCC(Nc1nc(Cl)cs1)C(N)=O
InChIInChI=1S/C6H8ClN3OS/c1-3(5(8)11)9-6-10-4(7)2-12-6/h2-3H,1H3,(H2,8,11)(H,9,10)
InChIKeyFUNMXSPZGSLLCY-UHFFFAOYSA-N
MW205.67 g/mol
LogP1.08
Rot. Bonds3

About 2-[(4-chloro-1,3-thiazol-2-yl)amino]propanamide

2-[(4-chloro-1,3-thiazol-2-yl)amino]propanamide (PubChem CID 83152052) has the molecular formula C6H8ClN3OS and a molecular weight of 205.67 g/mol. Its IUPAC name is 2-[(4-chloro-1,3-thiazol-2-yl)amino]propanamide.

Molecular Properties

Compound Name2-[(4-chloro-1,3-thiazol-2-yl)amino]propanamide
PubChem CID83152052
Molecular FormulaC6H8ClN3OS
Molecular Weight205.67 g/mol
Exact Mass205.01
IUPAC Name2-[(4-chloro-1,3-thiazol-2-yl)amino]propanamide
SMILESCC(Nc1nc(Cl)cs1)C(N)=O
InChIInChI=1S/C6H8ClN3OS/c1-3(5(8)11)9-6-10-4(7)2-12-6/h2-3H,1H3,(H2,8,11)(H,9,10)
InChIKeyFUNMXSPZGSLLCY-UHFFFAOYSA-N
XLogP1.08
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.67
LogP ≤ 51.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-[(4-chloro-1,3-thiazol-2-yl)amino]propanamide 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-[(4-chloro-1,3-thiazol-2-yl)amino]propanamide?
The IUPAC name of 2-[(4-chloro-1,3-thiazol-2-yl)amino]propanamide (CID 83152052) is 2-[(4-chloro-1,3-thiazol-2-yl)amino]propanamide.
What is the SMILES notation for 2-[(4-chloro-1,3-thiazol-2-yl)amino]propanamide?
The canonical SMILES for 2-[(4-chloro-1,3-thiazol-2-yl)amino]propanamide is CC(Nc1nc(Cl)cs1)C(N)=O.
What is the InChIKey of 2-[(4-chloro-1,3-thiazol-2-yl)amino]propanamide?
The InChIKey is FUNMXSPZGSLLCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8ClN3OS/c1-3(5(8)11)9-6-10-4(7)2-12-6/h2-3H,1H3,(H2,8,11)(H,9,10).
What are the key properties of 2-[(4-chloro-1,3-thiazol-2-yl)amino]propanamide?
2-[(4-chloro-1,3-thiazol-2-yl)amino]propanamide has a molecular weight of 205.67 g/mol, XLogP of 1.08, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-chloro-1,3-thiazol-2-yl)amino]propanamide is sourced from PubChem (CID 83152052), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).