2-(3-methyl-1,2-oxazol-5-yl)-1,1-diphenylethanol

C18H17NO2 — CID 852788

IUPAC2-(3-methyl-1,2-oxazol-5-yl)-1,1-diphenylethanol
SMILESCc1cc(CC(O)(c2ccccc2)c2ccccc2)on1
InChIInChI=1S/C18H17NO2/c1-14-12-17(21-19-14)13-18(20,15-8-4-2-5-9-15)16-10-6-3-7-11-16/h2-12,20H,13H2,1H3
InChIKeyUOQBMXMKCDGTOM-UHFFFAOYSA-N
MW279.34 g/mol
LogP3.46
Rot. Bonds4

About 2-(3-methyl-1,2-oxazol-5-yl)-1,1-diphenylethanol

2-(3-methyl-1,2-oxazol-5-yl)-1,1-diphenylethanol (PubChem CID 852788) has the molecular formula C18H17NO2 and a molecular weight of 279.34 g/mol. Its IUPAC name is 2-(3-methyl-1,2-oxazol-5-yl)-1,1-diphenylethanol.

Molecular Properties

Compound Name2-(3-methyl-1,2-oxazol-5-yl)-1,1-diphenylethanol
PubChem CID852788
Molecular FormulaC18H17NO2
Molecular Weight279.34 g/mol
Exact Mass279.13
IUPAC Name2-(3-methyl-1,2-oxazol-5-yl)-1,1-diphenylethanol
SMILESCc1cc(CC(O)(c2ccccc2)c2ccccc2)on1
InChIInChI=1S/C18H17NO2/c1-14-12-17(21-19-14)13-18(20,15-8-4-2-5-9-15)16-10-6-3-7-11-16/h2-12,20H,13H2,1H3
InChIKeyUOQBMXMKCDGTOM-UHFFFAOYSA-N
XLogP3.46
TPSA46.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.34
LogP ≤ 53.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(3-methyl-1,2-oxazol-5-yl)-1,1-diphenylethanol?
The IUPAC name of 2-(3-methyl-1,2-oxazol-5-yl)-1,1-diphenylethanol (CID 852788) is 2-(3-methyl-1,2-oxazol-5-yl)-1,1-diphenylethanol.
What is the SMILES notation for 2-(3-methyl-1,2-oxazol-5-yl)-1,1-diphenylethanol?
The canonical SMILES for 2-(3-methyl-1,2-oxazol-5-yl)-1,1-diphenylethanol is Cc1cc(CC(O)(c2ccccc2)c2ccccc2)on1.
What is the InChIKey of 2-(3-methyl-1,2-oxazol-5-yl)-1,1-diphenylethanol?
The InChIKey is UOQBMXMKCDGTOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17NO2/c1-14-12-17(21-19-14)13-18(20,15-8-4-2-5-9-15)16-10-6-3-7-11-16/h2-12,20H,13H2,1H3.
What are the key properties of 2-(3-methyl-1,2-oxazol-5-yl)-1,1-diphenylethanol?
2-(3-methyl-1,2-oxazol-5-yl)-1,1-diphenylethanol has a molecular weight of 279.34 g/mol, XLogP of 3.46, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methyl-1,2-oxazol-5-yl)-1,1-diphenylethanol is sourced from PubChem (CID 852788), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).