2-amino-2-[2-(5-chlorothiophen-2-yl)-1,3-thiazol-4-yl]ethanol

C9H9ClN2OS2 — CID 116890620

IUPAC2-amino-2-[2-(5-chlorothiophen-2-yl)-1,3-thiazol-4-yl]ethanol
SMILESNC(CO)c1csc(-c2ccc(Cl)s2)n1
InChIInChI=1S/C9H9ClN2OS2/c10-8-2-1-7(15-8)9-12-6(4-14-9)5(11)3-13/h1-2,4-5,13H,3,11H2
InChIKeyRFCINXGHDDPWJS-UHFFFAOYSA-N
MW260.77 g/mol
LogP2.52
Rot. Bonds3

About 2-amino-2-[2-(5-chlorothiophen-2-yl)-1,3-thiazol-4-yl]ethanol

2-amino-2-[2-(5-chlorothiophen-2-yl)-1,3-thiazol-4-yl]ethanol (PubChem CID 116890620) has the molecular formula C9H9ClN2OS2 and a molecular weight of 260.77 g/mol. Its IUPAC name is 2-amino-2-[2-(5-chlorothiophen-2-yl)-1,3-thiazol-4-yl]ethanol.

Molecular Properties

Compound Name2-amino-2-[2-(5-chlorothiophen-2-yl)-1,3-thiazol-4-yl]ethanol
PubChem CID116890620
Molecular FormulaC9H9ClN2OS2
Molecular Weight260.77 g/mol
Exact Mass259.98
IUPAC Name2-amino-2-[2-(5-chlorothiophen-2-yl)-1,3-thiazol-4-yl]ethanol
SMILESNC(CO)c1csc(-c2ccc(Cl)s2)n1
InChIInChI=1S/C9H9ClN2OS2/c10-8-2-1-7(15-8)9-12-6(4-14-9)5(11)3-13/h1-2,4-5,13H,3,11H2
InChIKeyRFCINXGHDDPWJS-UHFFFAOYSA-N
XLogP2.52
TPSA59.14 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.77
LogP ≤ 52.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 2-amino-2-[2-(5-chlorothiophen-2-yl)-1,3-thiazol-4-yl]ethanol 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-2-[2-(5-chlorothiophen-2-yl)-1,3-thiazol-4-yl]ethanol?
The IUPAC name of 2-amino-2-[2-(5-chlorothiophen-2-yl)-1,3-thiazol-4-yl]ethanol (CID 116890620) is 2-amino-2-[2-(5-chlorothiophen-2-yl)-1,3-thiazol-4-yl]ethanol.
What is the SMILES notation for 2-amino-2-[2-(5-chlorothiophen-2-yl)-1,3-thiazol-4-yl]ethanol?
The canonical SMILES for 2-amino-2-[2-(5-chlorothiophen-2-yl)-1,3-thiazol-4-yl]ethanol is NC(CO)c1csc(-c2ccc(Cl)s2)n1.
What is the InChIKey of 2-amino-2-[2-(5-chlorothiophen-2-yl)-1,3-thiazol-4-yl]ethanol?
The InChIKey is RFCINXGHDDPWJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9ClN2OS2/c10-8-2-1-7(15-8)9-12-6(4-14-9)5(11)3-13/h1-2,4-5,13H,3,11H2.
What are the key properties of 2-amino-2-[2-(5-chlorothiophen-2-yl)-1,3-thiazol-4-yl]ethanol?
2-amino-2-[2-(5-chlorothiophen-2-yl)-1,3-thiazol-4-yl]ethanol has a molecular weight of 260.77 g/mol, XLogP of 2.52, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-[2-(5-chlorothiophen-2-yl)-1,3-thiazol-4-yl]ethanol is sourced from PubChem (CID 116890620), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).