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

C7H11NOS — CID 130900894

IUPAC2-methyl-3-(1,2-thiazol-5-yl)propan-1-ol
SMILESCC(CO)Cc1ccns1
InChIInChI=1S/C7H11NOS/c1-6(5-9)4-7-2-3-8-10-7/h2-3,6,9H,4-5H2,1H3
InChIKeyFMMFXGNWAFQCTD-UHFFFAOYSA-N
MW157.24 g/mol
LogP1.31
Rot. Bonds3

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

2-methyl-3-(1,2-thiazol-5-yl)propan-1-ol (PubChem CID 130900894) has the molecular formula C7H11NOS and a molecular weight of 157.24 g/mol. Its IUPAC name is 2-methyl-3-(1,2-thiazol-5-yl)propan-1-ol.

Molecular Properties

Compound Name2-methyl-3-(1,2-thiazol-5-yl)propan-1-ol
PubChem CID130900894
Molecular FormulaC7H11NOS
Molecular Weight157.24 g/mol
Exact Mass157.06
IUPAC Name2-methyl-3-(1,2-thiazol-5-yl)propan-1-ol
SMILESCC(CO)Cc1ccns1
InChIInChI=1S/C7H11NOS/c1-6(5-9)4-7-2-3-8-10-7/h2-3,6,9H,4-5H2,1H3
InChIKeyFMMFXGNWAFQCTD-UHFFFAOYSA-N
XLogP1.31
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.24
LogP ≤ 51.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-(2-Methylpropyl)-1,2-thiazole
CID 12339566
5-Isopropylisothiazole
CID 23570577
CID 59269524
CID 59269524
5-Butan-2-yl-1,2-thiazole
CID 90348074
4-Methyl-1-[2-(1,2-thiazol-5-yl)ethyl]cyclohex-2-en-1-ol
CID 155190878
Ethane;5-propan-2-yl-1,2-thiazole
CID 159756343
4-(1,2-Thiazol-5-yl)butan-1-ol
CID 165722927
5-Pentan-3-yl-1,2-thiazole
CID 170709273
Ethane;5-(2-methylpropyl)-1,2-thiazole
CID 172328625
2-Amino-3-(1,2-thiazol-5-yl)propan-1-ol;hydrochloride
CID 55254257
2-Amino-3-(1,2-thiazol-5-yl)propan-1-ol
CID 55254258
2-(1,2-Thiazol-5-yl)ethan-1-ol
CID 56924619

Frequently Asked Questions

What is the IUPAC name of 2-methyl-3-(1,2-thiazol-5-yl)propan-1-ol?
The IUPAC name of 2-methyl-3-(1,2-thiazol-5-yl)propan-1-ol (CID 130900894) is 2-methyl-3-(1,2-thiazol-5-yl)propan-1-ol.
What is the SMILES notation for 2-methyl-3-(1,2-thiazol-5-yl)propan-1-ol?
The canonical SMILES for 2-methyl-3-(1,2-thiazol-5-yl)propan-1-ol is CC(CO)Cc1ccns1.
What is the InChIKey of 2-methyl-3-(1,2-thiazol-5-yl)propan-1-ol?
The InChIKey is FMMFXGNWAFQCTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11NOS/c1-6(5-9)4-7-2-3-8-10-7/h2-3,6,9H,4-5H2,1H3.
What are the key properties of 2-methyl-3-(1,2-thiazol-5-yl)propan-1-ol?
2-methyl-3-(1,2-thiazol-5-yl)propan-1-ol has a molecular weight of 157.24 g/mol, XLogP of 1.31, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-3-(1,2-thiazol-5-yl)propan-1-ol is sourced from PubChem (CID 130900894), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).