[5-(2-methyl-1,3-thiazol-4-yl)-1,2-oxazol-3-yl]methanol

C8H8N2O2S — CID 2776410

IUPAC[5-(2-methyl-1,3-thiazol-4-yl)-1,2-oxazol-3-yl]methanol
SMILESCc1nc(-c2cc(CO)no2)cs1
InChIInChI=1S/C8H8N2O2S/c1-5-9-7(4-13-5)8-2-6(3-11)10-12-8/h2,4,11H,3H2,1H3
InChIKeyANQHCDZMYKOBKX-UHFFFAOYSA-N
MW196.23 g/mol
LogP1.60
Rot. Bonds2

About [5-(2-methyl-1,3-thiazol-4-yl)-1,2-oxazol-3-yl]methanol

[5-(2-methyl-1,3-thiazol-4-yl)-1,2-oxazol-3-yl]methanol (PubChem CID 2776410) has the molecular formula C8H8N2O2S and a molecular weight of 196.23 g/mol. Its IUPAC name is [5-(2-methyl-1,3-thiazol-4-yl)-1,2-oxazol-3-yl]methanol.

Molecular Properties

Compound Name[5-(2-methyl-1,3-thiazol-4-yl)-1,2-oxazol-3-yl]methanol
PubChem CID2776410
Molecular FormulaC8H8N2O2S
Molecular Weight196.23 g/mol
Exact Mass196.03
IUPAC Name[5-(2-methyl-1,3-thiazol-4-yl)-1,2-oxazol-3-yl]methanol
SMILESCc1nc(-c2cc(CO)no2)cs1
InChIInChI=1S/C8H8N2O2S/c1-5-9-7(4-13-5)8-2-6(3-11)10-12-8/h2,4,11H,3H2,1H3
InChIKeyANQHCDZMYKOBKX-UHFFFAOYSA-N
XLogP1.60
TPSA59.15 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.23
LogP ≤ 51.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of [5-(2-methyl-1,3-thiazol-4-yl)-1,2-oxazol-3-yl]methanol?
The IUPAC name of [5-(2-methyl-1,3-thiazol-4-yl)-1,2-oxazol-3-yl]methanol (CID 2776410) is [5-(2-methyl-1,3-thiazol-4-yl)-1,2-oxazol-3-yl]methanol.
What is the SMILES notation for [5-(2-methyl-1,3-thiazol-4-yl)-1,2-oxazol-3-yl]methanol?
The canonical SMILES for [5-(2-methyl-1,3-thiazol-4-yl)-1,2-oxazol-3-yl]methanol is Cc1nc(-c2cc(CO)no2)cs1.
What is the InChIKey of [5-(2-methyl-1,3-thiazol-4-yl)-1,2-oxazol-3-yl]methanol?
The InChIKey is ANQHCDZMYKOBKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8N2O2S/c1-5-9-7(4-13-5)8-2-6(3-11)10-12-8/h2,4,11H,3H2,1H3.
What are the key properties of [5-(2-methyl-1,3-thiazol-4-yl)-1,2-oxazol-3-yl]methanol?
[5-(2-methyl-1,3-thiazol-4-yl)-1,2-oxazol-3-yl]methanol has a molecular weight of 196.23 g/mol, XLogP of 1.60, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(2-methyl-1,3-thiazol-4-yl)-1,2-oxazol-3-yl]methanol is sourced from PubChem (CID 2776410), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).