(2-propan-2-yl-1,3-thiazol-4-yl)methanol

C7H11NOS — CID 10534937

IUPAC(2-propan-2-yl-1,3-thiazol-4-yl)methanol
SMILESCC(C)c1nc(CO)cs1
InChIInChI=1S/C7H11NOS/c1-5(2)7-8-6(3-9)4-10-7/h4-5,9H,3H2,1-2H3
InChIKeyDRSAHDPLRNPPMJ-UHFFFAOYSA-N
MW157.24 g/mol
LogP1.76
Rot. Bonds2

About (2-propan-2-yl-1,3-thiazol-4-yl)methanol

(2-propan-2-yl-1,3-thiazol-4-yl)methanol (PubChem CID 10534937) has the molecular formula C7H11NOS and a molecular weight of 157.24 g/mol. Its IUPAC name is (2-propan-2-yl-1,3-thiazol-4-yl)methanol.

Molecular Properties

Compound Name(2-propan-2-yl-1,3-thiazol-4-yl)methanol
PubChem CID10534937
Molecular FormulaC7H11NOS
Molecular Weight157.24 g/mol
Exact Mass157.06
IUPAC Name(2-propan-2-yl-1,3-thiazol-4-yl)methanol
SMILESCC(C)c1nc(CO)cs1
InChIInChI=1S/C7H11NOS/c1-5(2)7-8-6(3-9)4-10-7/h4-5,9H,3H2,1-2H3
InChIKeyDRSAHDPLRNPPMJ-UHFFFAOYSA-N
XLogP1.76
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 ≤ 51.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (2-propan-2-yl-1,3-thiazol-4-yl)methanol 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

(2-((Dimethylamino)methyl)thiazol-4-yl)methanol
CID 1838020
1-(4-Methyl-1,3-thiazol-2-yl)ethan-1-ol
CID 15444827
(2-Bromo-1,3-thiazol-4-yl)methanol
CID 2763211
(4-Methyl-1,3-thiazol-2-yl)methanol
CID 17750909
(2-Methyl-1,3-thiazol-4-yl)methanol
CID 10582809
2,2,2-Trifluoro-1-(4-methyl-1,3-thiazol-2-yl)ethan-1-ol
CID 16322147
(2-Ethyl-1,3-thiazol-4-yl)methanol
CID 16494965
(2-Tert-butyl-1,3-thiazol-4-yl)methanol
CID 16494972
[2-(Trifluoromethyl)-1,3-thiazol-4-yl]methanol
CID 20079604
(2-Chloro-1,3-thiazol-4-yl)methanol
CID 21985817
(4-Ethyl-1,3-thiazol-2-yl)methanol
CID 58767059
(1R)-1-(2-methyl-1,3-thiazol-4-yl)ethan-1-ol
CID 63365053

Frequently Asked Questions

What is the IUPAC name of (2-propan-2-yl-1,3-thiazol-4-yl)methanol?
The IUPAC name of (2-propan-2-yl-1,3-thiazol-4-yl)methanol (CID 10534937) is (2-propan-2-yl-1,3-thiazol-4-yl)methanol.
What is the SMILES notation for (2-propan-2-yl-1,3-thiazol-4-yl)methanol?
The canonical SMILES for (2-propan-2-yl-1,3-thiazol-4-yl)methanol is CC(C)c1nc(CO)cs1.
What is the InChIKey of (2-propan-2-yl-1,3-thiazol-4-yl)methanol?
The InChIKey is DRSAHDPLRNPPMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11NOS/c1-5(2)7-8-6(3-9)4-10-7/h4-5,9H,3H2,1-2H3.
What are the key properties of (2-propan-2-yl-1,3-thiazol-4-yl)methanol?
(2-propan-2-yl-1,3-thiazol-4-yl)methanol has a molecular weight of 157.24 g/mol, XLogP of 1.76, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-propan-2-yl-1,3-thiazol-4-yl)methanol is sourced from PubChem (CID 10534937), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).