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

C7H11NOS — CID 22083608

IUPAC2-(2-methyl-1,3-thiazol-5-yl)propan-2-ol
SMILESCc1ncc(C(C)(C)O)s1
InChIInChI=1S/C7H11NOS/c1-5-8-4-6(10-5)7(2,3)9/h4,9H,1-3H3
InChIKeyWRXQNBXHJDGDEF-UHFFFAOYSA-N
MW157.24 g/mol
LogP1.68
Rot. Bonds1

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

2-(2-methyl-1,3-thiazol-5-yl)propan-2-ol (PubChem CID 22083608) has the molecular formula C7H11NOS and a molecular weight of 157.24 g/mol. Its IUPAC name is 2-(2-methyl-1,3-thiazol-5-yl)propan-2-ol.

Molecular Properties

Compound Name2-(2-methyl-1,3-thiazol-5-yl)propan-2-ol
PubChem CID22083608
Molecular FormulaC7H11NOS
Molecular Weight157.24 g/mol
Exact Mass157.06
IUPAC Name2-(2-methyl-1,3-thiazol-5-yl)propan-2-ol
SMILESCc1ncc(C(C)(C)O)s1
InChIInChI=1S/C7H11NOS/c1-5-8-4-6(10-5)7(2,3)9/h4,9H,1-3H3
InChIKeyWRXQNBXHJDGDEF-UHFFFAOYSA-N
XLogP1.68
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.24
LogP ≤ 51.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(2-methyl-1,3-thiazol-5-yl)propan-2-ol?
The IUPAC name of 2-(2-methyl-1,3-thiazol-5-yl)propan-2-ol (CID 22083608) is 2-(2-methyl-1,3-thiazol-5-yl)propan-2-ol.
What is the SMILES notation for 2-(2-methyl-1,3-thiazol-5-yl)propan-2-ol?
The canonical SMILES for 2-(2-methyl-1,3-thiazol-5-yl)propan-2-ol is Cc1ncc(C(C)(C)O)s1.
What is the InChIKey of 2-(2-methyl-1,3-thiazol-5-yl)propan-2-ol?
The InChIKey is WRXQNBXHJDGDEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11NOS/c1-5-8-4-6(10-5)7(2,3)9/h4,9H,1-3H3.
What are the key properties of 2-(2-methyl-1,3-thiazol-5-yl)propan-2-ol?
2-(2-methyl-1,3-thiazol-5-yl)propan-2-ol has a molecular weight of 157.24 g/mol, XLogP of 1.68, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methyl-1,3-thiazol-5-yl)propan-2-ol is sourced from PubChem (CID 22083608), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).