[2-(2-methylphenyl)-1,3-oxazol-4-yl]methanol

C11H11NO2 — CID 55255073

IUPAC[2-(2-methylphenyl)-1,3-oxazol-4-yl]methanol
SMILESCc1ccccc1-c1nc(CO)co1
InChIInChI=1S/C11H11NO2/c1-8-4-2-3-5-10(8)11-12-9(6-13)7-14-11/h2-5,7,13H,6H2,1H3
InChIKeyHDQIBOILSFYROR-UHFFFAOYSA-N
MW189.21 g/mol
LogP2.14
Rot. Bonds2

About [2-(2-methylphenyl)-1,3-oxazol-4-yl]methanol

[2-(2-methylphenyl)-1,3-oxazol-4-yl]methanol (PubChem CID 55255073) has the molecular formula C11H11NO2 and a molecular weight of 189.21 g/mol. Its IUPAC name is [2-(2-methylphenyl)-1,3-oxazol-4-yl]methanol.

Molecular Properties

Compound Name[2-(2-methylphenyl)-1,3-oxazol-4-yl]methanol
PubChem CID55255073
Molecular FormulaC11H11NO2
Molecular Weight189.21 g/mol
Exact Mass189.08
IUPAC Name[2-(2-methylphenyl)-1,3-oxazol-4-yl]methanol
SMILESCc1ccccc1-c1nc(CO)co1
InChIInChI=1S/C11H11NO2/c1-8-4-2-3-5-10(8)11-12-9(6-13)7-14-11/h2-5,7,13H,6H2,1H3
InChIKeyHDQIBOILSFYROR-UHFFFAOYSA-N
XLogP2.14
TPSA46.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.21
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [2-(2-methylphenyl)-1,3-oxazol-4-yl]methanol?
The IUPAC name of [2-(2-methylphenyl)-1,3-oxazol-4-yl]methanol (CID 55255073) is [2-(2-methylphenyl)-1,3-oxazol-4-yl]methanol.
What is the SMILES notation for [2-(2-methylphenyl)-1,3-oxazol-4-yl]methanol?
The canonical SMILES for [2-(2-methylphenyl)-1,3-oxazol-4-yl]methanol is Cc1ccccc1-c1nc(CO)co1.
What is the InChIKey of [2-(2-methylphenyl)-1,3-oxazol-4-yl]methanol?
The InChIKey is HDQIBOILSFYROR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11NO2/c1-8-4-2-3-5-10(8)11-12-9(6-13)7-14-11/h2-5,7,13H,6H2,1H3.
What are the key properties of [2-(2-methylphenyl)-1,3-oxazol-4-yl]methanol?
[2-(2-methylphenyl)-1,3-oxazol-4-yl]methanol has a molecular weight of 189.21 g/mol, XLogP of 2.14, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2-methylphenyl)-1,3-oxazol-4-yl]methanol is sourced from PubChem (CID 55255073), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).