3-phenyl-5-(2-phenylethyl)-4H-1,2-oxazol-5-ol

C17H17NO2 — CID 12028159

IUPAC3-phenyl-5-(2-phenylethyl)-4H-1,2-oxazol-5-ol
SMILESOC1(CCc2ccccc2)CC(c2ccccc2)=NO1
InChIInChI=1S/C17H17NO2/c19-17(12-11-14-7-3-1-4-8-14)13-16(18-20-17)15-9-5-2-6-10-15/h1-10,19H,11-13H2
InChIKeyYDOURKYUIPIFKX-UHFFFAOYSA-N
MW267.33 g/mol
LogP3.13
Rot. Bonds4

About 3-phenyl-5-(2-phenylethyl)-4H-1,2-oxazol-5-ol

3-phenyl-5-(2-phenylethyl)-4H-1,2-oxazol-5-ol (PubChem CID 12028159) has the molecular formula C17H17NO2 and a molecular weight of 267.33 g/mol. Its IUPAC name is 3-phenyl-5-(2-phenylethyl)-4H-1,2-oxazol-5-ol.

Molecular Properties

Compound Name3-phenyl-5-(2-phenylethyl)-4H-1,2-oxazol-5-ol
PubChem CID12028159
Molecular FormulaC17H17NO2
Molecular Weight267.33 g/mol
Exact Mass267.13
IUPAC Name3-phenyl-5-(2-phenylethyl)-4H-1,2-oxazol-5-ol
SMILESOC1(CCc2ccccc2)CC(c2ccccc2)=NO1
InChIInChI=1S/C17H17NO2/c19-17(12-11-14-7-3-1-4-8-14)13-16(18-20-17)15-9-5-2-6-10-15/h1-10,19H,11-13H2
InChIKeyYDOURKYUIPIFKX-UHFFFAOYSA-N
XLogP3.13
TPSA41.82 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.33
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(3,5-diphenyl-4H-1,2-oxazol-5-yl)methanol
CID 14688929
(5S)-5-methyl-3-phenyl-N-(2-phenylethyl)-4H-1,2-oxazole-5-carboxamide
CID 97465490
3-(2-phenylethyl)oxetan-3-ol
CID 83683318
5-amino-3-phenyl-4H-1,2-oxazole-5-carboxylic acid
CID 11790369
5-(chloromethyl)-5-methyl-3-phenyl-4H-1,2-oxazole
CID 12533400
(5S)-3-(2-phenylethyl)-5-(trichloromethyl)-4H-1,2-oxazol-5-ol
CID 71745008
1-(2-phenylethyl)cyclopent-3-en-1-ol
CID 139771599
3-phenyl-1-oxa-2,8-diazaspiro[4.5]dec-2-ene-8-carboxylic acid
CID 69317469
5-methyl-3-phenyl-4H-1,2-oxazole-5-carboxamide
CID 53016965
(5R)-5-methyl-3-phenyl-4H-1,2-oxazole-5-carboxylate
CID 7446724
(5R)-5-methyl-3-phenyl-4H-1,2-oxazole-5-carboxamide
CID 95051942
[1-(2-phenylethyl)cyclobutyl]methanol
CID 58979662

Frequently Asked Questions

What is the IUPAC name of 3-phenyl-5-(2-phenylethyl)-4H-1,2-oxazol-5-ol?
The IUPAC name of 3-phenyl-5-(2-phenylethyl)-4H-1,2-oxazol-5-ol (CID 12028159) is 3-phenyl-5-(2-phenylethyl)-4H-1,2-oxazol-5-ol.
What is the SMILES notation for 3-phenyl-5-(2-phenylethyl)-4H-1,2-oxazol-5-ol?
The canonical SMILES for 3-phenyl-5-(2-phenylethyl)-4H-1,2-oxazol-5-ol is OC1(CCc2ccccc2)CC(c2ccccc2)=NO1.
What is the InChIKey of 3-phenyl-5-(2-phenylethyl)-4H-1,2-oxazol-5-ol?
The InChIKey is YDOURKYUIPIFKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17NO2/c19-17(12-11-14-7-3-1-4-8-14)13-16(18-20-17)15-9-5-2-6-10-15/h1-10,19H,11-13H2.
What are the key properties of 3-phenyl-5-(2-phenylethyl)-4H-1,2-oxazol-5-ol?
3-phenyl-5-(2-phenylethyl)-4H-1,2-oxazol-5-ol has a molecular weight of 267.33 g/mol, XLogP of 3.13, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-phenyl-5-(2-phenylethyl)-4H-1,2-oxazol-5-ol is sourced from PubChem (CID 12028159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).