2-(2,4-dimethyl-1,3-thiazol-5-yl)ethanol

C7H11NOS — CID 58820336

IUPAC2-(2,4-dimethyl-1,3-thiazol-5-yl)ethanol
SMILESCc1nc(C)c(CCO)s1
InChIInChI=1S/C7H11NOS/c1-5-7(3-4-9)10-6(2)8-5/h9H,3-4H2,1-2H3
InChIKeyBQQBMZMSRDSGKP-UHFFFAOYSA-N
MW157.24 g/mol
LogP1.29
Rot. Bonds2

About 2-(2,4-dimethyl-1,3-thiazol-5-yl)ethanol

2-(2,4-dimethyl-1,3-thiazol-5-yl)ethanol (PubChem CID 58820336) has the molecular formula C7H11NOS and a molecular weight of 157.24 g/mol. Its IUPAC name is 2-(2,4-dimethyl-1,3-thiazol-5-yl)ethanol.

Molecular Properties

Compound Name2-(2,4-dimethyl-1,3-thiazol-5-yl)ethanol
PubChem CID58820336
Molecular FormulaC7H11NOS
Molecular Weight157.24 g/mol
Exact Mass157.06
IUPAC Name2-(2,4-dimethyl-1,3-thiazol-5-yl)ethanol
SMILESCc1nc(C)c(CCO)s1
InChIInChI=1S/C7H11NOS/c1-5-7(3-4-9)10-6(2)8-5/h9H,3-4H2,1-2H3
InChIKeyBQQBMZMSRDSGKP-UHFFFAOYSA-N
XLogP1.29
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 ≤ 51.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dimethyl-1,3-thiazol-5-yl)ethanol?
The IUPAC name of 2-(2,4-dimethyl-1,3-thiazol-5-yl)ethanol (CID 58820336) is 2-(2,4-dimethyl-1,3-thiazol-5-yl)ethanol.
What is the SMILES notation for 2-(2,4-dimethyl-1,3-thiazol-5-yl)ethanol?
The canonical SMILES for 2-(2,4-dimethyl-1,3-thiazol-5-yl)ethanol is Cc1nc(C)c(CCO)s1.
What is the InChIKey of 2-(2,4-dimethyl-1,3-thiazol-5-yl)ethanol?
The InChIKey is BQQBMZMSRDSGKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11NOS/c1-5-7(3-4-9)10-6(2)8-5/h9H,3-4H2,1-2H3.
What are the key properties of 2-(2,4-dimethyl-1,3-thiazol-5-yl)ethanol?
2-(2,4-dimethyl-1,3-thiazol-5-yl)ethanol has a molecular weight of 157.24 g/mol, XLogP of 1.29, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dimethyl-1,3-thiazol-5-yl)ethanol is sourced from PubChem (CID 58820336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).