[2-methyl-3-(1,3-thiazol-2-ylmethyl)oxolan-3-yl]methanol

C10H15NO2S — CID 114535607

IUPAC[2-methyl-3-(1,3-thiazol-2-ylmethyl)oxolan-3-yl]methanol
SMILESCC1OCCC1(CO)Cc1nccs1
InChIInChI=1S/C10H15NO2S/c1-8-10(7-12,2-4-13-8)6-9-11-3-5-14-9/h3,5,8,12H,2,4,6-7H2,1H3
InChIKeyGKFYVUYMXQOOST-UHFFFAOYSA-N
MW213.30 g/mol
LogP1.47
Rot. Bonds3

About [2-methyl-3-(1,3-thiazol-2-ylmethyl)oxolan-3-yl]methanol

[2-methyl-3-(1,3-thiazol-2-ylmethyl)oxolan-3-yl]methanol (PubChem CID 114535607) has the molecular formula C10H15NO2S and a molecular weight of 213.30 g/mol. Its IUPAC name is [2-methyl-3-(1,3-thiazol-2-ylmethyl)oxolan-3-yl]methanol.

Molecular Properties

Compound Name[2-methyl-3-(1,3-thiazol-2-ylmethyl)oxolan-3-yl]methanol
PubChem CID114535607
Molecular FormulaC10H15NO2S
Molecular Weight213.30 g/mol
Exact Mass213.08
IUPAC Name[2-methyl-3-(1,3-thiazol-2-ylmethyl)oxolan-3-yl]methanol
SMILESCC1OCCC1(CO)Cc1nccs1
InChIInChI=1S/C10H15NO2S/c1-8-10(7-12,2-4-13-8)6-9-11-3-5-14-9/h3,5,8,12H,2,4,6-7H2,1H3
InChIKeyGKFYVUYMXQOOST-UHFFFAOYSA-N
XLogP1.47
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.30
LogP ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [2-methyl-3-(1,3-thiazol-2-ylmethyl)oxolan-3-yl]methanol?
The IUPAC name of [2-methyl-3-(1,3-thiazol-2-ylmethyl)oxolan-3-yl]methanol (CID 114535607) is [2-methyl-3-(1,3-thiazol-2-ylmethyl)oxolan-3-yl]methanol.
What is the SMILES notation for [2-methyl-3-(1,3-thiazol-2-ylmethyl)oxolan-3-yl]methanol?
The canonical SMILES for [2-methyl-3-(1,3-thiazol-2-ylmethyl)oxolan-3-yl]methanol is CC1OCCC1(CO)Cc1nccs1.
What is the InChIKey of [2-methyl-3-(1,3-thiazol-2-ylmethyl)oxolan-3-yl]methanol?
The InChIKey is GKFYVUYMXQOOST-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO2S/c1-8-10(7-12,2-4-13-8)6-9-11-3-5-14-9/h3,5,8,12H,2,4,6-7H2,1H3.
What are the key properties of [2-methyl-3-(1,3-thiazol-2-ylmethyl)oxolan-3-yl]methanol?
[2-methyl-3-(1,3-thiazol-2-ylmethyl)oxolan-3-yl]methanol has a molecular weight of 213.30 g/mol, XLogP of 1.47, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-methyl-3-(1,3-thiazol-2-ylmethyl)oxolan-3-yl]methanol is sourced from PubChem (CID 114535607), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).