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

C8H8N2O2S — CID 130927982

IUPAC(2-methyl-1,3-oxazol-4-yl)-(1,2-thiazol-3-yl)methanol
SMILESCc1nc(C(O)c2ccsn2)co1
InChIInChI=1S/C8H8N2O2S/c1-5-9-7(4-12-5)8(11)6-2-3-13-10-6/h2-4,8,11H,1H3
InChIKeySXQLWJLRZXODQV-UHFFFAOYSA-N
MW196.23 g/mol
LogP1.52
Rot. Bonds2

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

(2-methyl-1,3-oxazol-4-yl)-(1,2-thiazol-3-yl)methanol (PubChem CID 130927982) has the molecular formula C8H8N2O2S and a molecular weight of 196.23 g/mol. Its IUPAC name is (2-methyl-1,3-oxazol-4-yl)-(1,2-thiazol-3-yl)methanol.

Molecular Properties

Compound Name(2-methyl-1,3-oxazol-4-yl)-(1,2-thiazol-3-yl)methanol
PubChem CID130927982
Molecular FormulaC8H8N2O2S
Molecular Weight196.23 g/mol
Exact Mass196.03
IUPAC Name(2-methyl-1,3-oxazol-4-yl)-(1,2-thiazol-3-yl)methanol
SMILESCc1nc(C(O)c2ccsn2)co1
InChIInChI=1S/C8H8N2O2S/c1-5-9-7(4-12-5)8(11)6-2-3-13-10-6/h2-4,8,11H,1H3
InChIKeySXQLWJLRZXODQV-UHFFFAOYSA-N
XLogP1.52
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 ≤ 51.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-(1,2-thiazol-3-yl)propane-1,2-diol
CID 130604797
(4-methylfuran-3-yl)-(2-methyl-1,3-oxazol-4-yl)methanol
CID 130825734
(2-methyl-1,3-thiazol-5-yl)-(1,2-thiazol-3-yl)methanol
CID 131064888
2,2,2-trifluoro-1-(2-methyl-1,3-oxazol-4-yl)ethanol
CID 122677791
(5-bromofuran-2-yl)-(1,2-thiazol-3-yl)methanol
CID 131101510
(2-fluoro-3-methoxyphenyl)-(2-methyl-1,3-oxazol-4-yl)methanol
CID 114282584
(2-methyl-1,3-oxazol-4-yl)-(3-propylphenyl)methanol
CID 114282576
2-methyl-1-(1,2-thiazol-3-yl)butan-1-ol
CID 131020007
1-(2-methyl-1,3-oxazol-4-yl)pent-4-yn-1-ol
CID 130517640
2,2-dimethyl-1-(1,2-thiazol-3-yl)butan-1-ol
CID 130727781
3-pentan-3-yl-1,2-thiazole
CID 170381206
2-methyl-4-propan-2-yl-1,3-oxazole;3-methyl-5-propan-2-yl-1,2-thiazole
CID 177223563

Frequently Asked Questions

What is the IUPAC name of (2-methyl-1,3-oxazol-4-yl)-(1,2-thiazol-3-yl)methanol?
The IUPAC name of (2-methyl-1,3-oxazol-4-yl)-(1,2-thiazol-3-yl)methanol (CID 130927982) is (2-methyl-1,3-oxazol-4-yl)-(1,2-thiazol-3-yl)methanol.
What is the SMILES notation for (2-methyl-1,3-oxazol-4-yl)-(1,2-thiazol-3-yl)methanol?
The canonical SMILES for (2-methyl-1,3-oxazol-4-yl)-(1,2-thiazol-3-yl)methanol is Cc1nc(C(O)c2ccsn2)co1.
What is the InChIKey of (2-methyl-1,3-oxazol-4-yl)-(1,2-thiazol-3-yl)methanol?
The InChIKey is SXQLWJLRZXODQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8N2O2S/c1-5-9-7(4-12-5)8(11)6-2-3-13-10-6/h2-4,8,11H,1H3.
What are the key properties of (2-methyl-1,3-oxazol-4-yl)-(1,2-thiazol-3-yl)methanol?
(2-methyl-1,3-oxazol-4-yl)-(1,2-thiazol-3-yl)methanol has a molecular weight of 196.23 g/mol, XLogP of 1.52, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methyl-1,3-oxazol-4-yl)-(1,2-thiazol-3-yl)methanol is sourced from PubChem (CID 130927982), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).