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

C13H15NO2 — CID 105470995

IUPAC[3-(5-ethyl-2-methyl-1,3-oxazol-4-yl)phenyl]methanol
SMILESCCc1oc(C)nc1-c1cccc(CO)c1
InChIInChI=1S/C13H15NO2/c1-3-12-13(14-9(2)16-12)11-6-4-5-10(7-11)8-15/h4-7,15H,3,8H2,1-2H3
InChIKeyXZEYFQRSXDOIMF-UHFFFAOYSA-N
MW217.27 g/mol
LogP2.70
Rot. Bonds3

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

[3-(5-ethyl-2-methyl-1,3-oxazol-4-yl)phenyl]methanol (PubChem CID 105470995) has the molecular formula C13H15NO2 and a molecular weight of 217.27 g/mol. Its IUPAC name is [3-(5-ethyl-2-methyl-1,3-oxazol-4-yl)phenyl]methanol.

Molecular Properties

Compound Name[3-(5-ethyl-2-methyl-1,3-oxazol-4-yl)phenyl]methanol
PubChem CID105470995
Molecular FormulaC13H15NO2
Molecular Weight217.27 g/mol
Exact Mass217.11
IUPAC Name[3-(5-ethyl-2-methyl-1,3-oxazol-4-yl)phenyl]methanol
SMILESCCc1oc(C)nc1-c1cccc(CO)c1
InChIInChI=1S/C13H15NO2/c1-3-12-13(14-9(2)16-12)11-6-4-5-10(7-11)8-15/h4-7,15H,3,8H2,1-2H3
InChIKeyXZEYFQRSXDOIMF-UHFFFAOYSA-N
XLogP2.70
TPSA46.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.27
LogP ≤ 52.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [3-(5-ethyl-2-methyl-1,3-oxazol-4-yl)phenyl]methanol?
The IUPAC name of [3-(5-ethyl-2-methyl-1,3-oxazol-4-yl)phenyl]methanol (CID 105470995) is [3-(5-ethyl-2-methyl-1,3-oxazol-4-yl)phenyl]methanol.
What is the SMILES notation for [3-(5-ethyl-2-methyl-1,3-oxazol-4-yl)phenyl]methanol?
The canonical SMILES for [3-(5-ethyl-2-methyl-1,3-oxazol-4-yl)phenyl]methanol is CCc1oc(C)nc1-c1cccc(CO)c1.
What is the InChIKey of [3-(5-ethyl-2-methyl-1,3-oxazol-4-yl)phenyl]methanol?
The InChIKey is XZEYFQRSXDOIMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15NO2/c1-3-12-13(14-9(2)16-12)11-6-4-5-10(7-11)8-15/h4-7,15H,3,8H2,1-2H3.
What are the key properties of [3-(5-ethyl-2-methyl-1,3-oxazol-4-yl)phenyl]methanol?
[3-(5-ethyl-2-methyl-1,3-oxazol-4-yl)phenyl]methanol has a molecular weight of 217.27 g/mol, XLogP of 2.70, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(5-ethyl-2-methyl-1,3-oxazol-4-yl)phenyl]methanol is sourced from PubChem (CID 105470995), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).