2-(2-phenyl-5-propan-2-yl-1,3-oxazol-4-yl)ethanol

C14H17NO2 — CID 70178572

IUPAC2-(2-phenyl-5-propan-2-yl-1,3-oxazol-4-yl)ethanol
SMILESCC(C)c1oc(-c2ccccc2)nc1CCO
InChIInChI=1S/C14H17NO2/c1-10(2)13-12(8-9-16)15-14(17-13)11-6-4-3-5-7-11/h3-7,10,16H,8-9H2,1-2H3
InChIKeyRDGNPCQIIGTNAS-UHFFFAOYSA-N
MW231.29 g/mol
LogP3.00
Rot. Bonds4

About 2-(2-phenyl-5-propan-2-yl-1,3-oxazol-4-yl)ethanol

2-(2-phenyl-5-propan-2-yl-1,3-oxazol-4-yl)ethanol (PubChem CID 70178572) has the molecular formula C14H17NO2 and a molecular weight of 231.29 g/mol. Its IUPAC name is 2-(2-phenyl-5-propan-2-yl-1,3-oxazol-4-yl)ethanol.

Molecular Properties

Compound Name2-(2-phenyl-5-propan-2-yl-1,3-oxazol-4-yl)ethanol
PubChem CID70178572
Molecular FormulaC14H17NO2
Molecular Weight231.29 g/mol
Exact Mass231.13
IUPAC Name2-(2-phenyl-5-propan-2-yl-1,3-oxazol-4-yl)ethanol
SMILESCC(C)c1oc(-c2ccccc2)nc1CCO
InChIInChI=1S/C14H17NO2/c1-10(2)13-12(8-9-16)15-14(17-13)11-6-4-3-5-7-11/h3-7,10,16H,8-9H2,1-2H3
InChIKeyRDGNPCQIIGTNAS-UHFFFAOYSA-N
XLogP3.00
TPSA46.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.29
LogP ≤ 53.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(chloromethyl)-2-phenyl-5-propan-2-yl-1,3-oxazole
CID 102363467
methyl 2-phenyl-5-propan-2-yl-1,3-oxazole-4-carboxylate
CID 58874245
4-[2-[2-(4-fluorophenyl)-5-propan-2-yl-1,3-oxazol-4-yl]ethoxy]aniline
CID 18473907
(2S)-2-[[2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)acetyl]amino]propanoic acid
CID 119238230
(2R)-1-[[4-[2-(2-phenyl-5-propan-2-yl-1,3-oxazol-4-yl)ethoxy]phenyl]methyl]pyrrolidine-2-carboxylic acid
CID 69171238
4-(5-bromopentyl)-5-methyl-2-phenyl-1,3-oxazole;5-(5-methyl-2-phenyl-1,3-oxazol-4-yl)pentan-1-ol
CID 159710828
4-ethyl-5-propan-2-yl-2-[3-(trifluoromethyl)phenyl]-1,3-oxazole
CID 142936042
2-[5-ethyl-2-(4-fluorophenyl)-1,3-oxazol-4-yl]ethanol
CID 18376373
(5-methyl-2-phenyl-1,3-oxazol-4-yl)methanamine
CID 15616431
N-(4-hydroxy-2-methylpentyl)-2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)acetamide
CID 111447499
2-[2-[3-(4,5-dimethyl-1,3-oxazol-2-yl)phenyl]-5-methyl-1,3-oxazol-4-yl]ethanol;ethane;ethanol
CID 142910946
5-(1-methylsulfonylethyl)-2-phenyl-1,3-oxazole-4-carboxylic acid
CID 104517924

Frequently Asked Questions

What is the IUPAC name of 2-(2-phenyl-5-propan-2-yl-1,3-oxazol-4-yl)ethanol?
The IUPAC name of 2-(2-phenyl-5-propan-2-yl-1,3-oxazol-4-yl)ethanol (CID 70178572) is 2-(2-phenyl-5-propan-2-yl-1,3-oxazol-4-yl)ethanol.
What is the SMILES notation for 2-(2-phenyl-5-propan-2-yl-1,3-oxazol-4-yl)ethanol?
The canonical SMILES for 2-(2-phenyl-5-propan-2-yl-1,3-oxazol-4-yl)ethanol is CC(C)c1oc(-c2ccccc2)nc1CCO.
What is the InChIKey of 2-(2-phenyl-5-propan-2-yl-1,3-oxazol-4-yl)ethanol?
The InChIKey is RDGNPCQIIGTNAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17NO2/c1-10(2)13-12(8-9-16)15-14(17-13)11-6-4-3-5-7-11/h3-7,10,16H,8-9H2,1-2H3.
What are the key properties of 2-(2-phenyl-5-propan-2-yl-1,3-oxazol-4-yl)ethanol?
2-(2-phenyl-5-propan-2-yl-1,3-oxazol-4-yl)ethanol has a molecular weight of 231.29 g/mol, XLogP of 3.00, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-phenyl-5-propan-2-yl-1,3-oxazol-4-yl)ethanol is sourced from PubChem (CID 70178572), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).