1-(3-methyl-1,2-thiazol-5-yl)propan-2-ol

C7H11NOS — CID 83675112

IUPAC1-(3-methyl-1,2-thiazol-5-yl)propan-2-ol
SMILESCc1cc(CC(C)O)sn1
InChIInChI=1S/C7H11NOS/c1-5-3-7(10-8-5)4-6(2)9/h3,6,9H,4H2,1-2H3
InChIKeyRUJPNOVDODOJSX-UHFFFAOYSA-N
MW157.24 g/mol
LogP1.37
Rot. Bonds2

About 1-(3-methyl-1,2-thiazol-5-yl)propan-2-ol

1-(3-methyl-1,2-thiazol-5-yl)propan-2-ol (PubChem CID 83675112) has the molecular formula C7H11NOS and a molecular weight of 157.24 g/mol. Its IUPAC name is 1-(3-methyl-1,2-thiazol-5-yl)propan-2-ol.

Molecular Properties

Compound Name1-(3-methyl-1,2-thiazol-5-yl)propan-2-ol
PubChem CID83675112
Molecular FormulaC7H11NOS
Molecular Weight157.24 g/mol
Exact Mass157.06
IUPAC Name1-(3-methyl-1,2-thiazol-5-yl)propan-2-ol
SMILESCc1cc(CC(C)O)sn1
InChIInChI=1S/C7H11NOS/c1-5-3-7(10-8-5)4-6(2)9/h3,6,9H,4H2,1-2H3
InChIKeyRUJPNOVDODOJSX-UHFFFAOYSA-N
XLogP1.37
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.24
LogP ≤ 51.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-(3-methyl-1,2-thiazol-5-yl)propan-2-ol 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 1-(3-methyl-1,2-thiazol-5-yl)propan-2-ol?
The IUPAC name of 1-(3-methyl-1,2-thiazol-5-yl)propan-2-ol (CID 83675112) is 1-(3-methyl-1,2-thiazol-5-yl)propan-2-ol.
What is the SMILES notation for 1-(3-methyl-1,2-thiazol-5-yl)propan-2-ol?
The canonical SMILES for 1-(3-methyl-1,2-thiazol-5-yl)propan-2-ol is Cc1cc(CC(C)O)sn1.
What is the InChIKey of 1-(3-methyl-1,2-thiazol-5-yl)propan-2-ol?
The InChIKey is RUJPNOVDODOJSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11NOS/c1-5-3-7(10-8-5)4-6(2)9/h3,6,9H,4H2,1-2H3.
What are the key properties of 1-(3-methyl-1,2-thiazol-5-yl)propan-2-ol?
1-(3-methyl-1,2-thiazol-5-yl)propan-2-ol has a molecular weight of 157.24 g/mol, XLogP of 1.37, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-methyl-1,2-thiazol-5-yl)propan-2-ol is sourced from PubChem (CID 83675112), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).