2-(2-phenyl-3H-1,3-benzoxazol-2-yl)ethanol

C15H15NO2 — CID 102526997

IUPAC2-(2-phenyl-3H-1,3-benzoxazol-2-yl)ethanol
SMILESOCCC1(c2ccccc2)Nc2ccccc2O1
InChIInChI=1S/C15H15NO2/c17-11-10-15(12-6-2-1-3-7-12)16-13-8-4-5-9-14(13)18-15/h1-9,16-17H,10-11H2
InChIKeyLYQZQSQNFFPYJA-UHFFFAOYSA-N
MW241.29 g/mol
LogP2.73
Rot. Bonds3

About 2-(2-phenyl-3H-1,3-benzoxazol-2-yl)ethanol

2-(2-phenyl-3H-1,3-benzoxazol-2-yl)ethanol (PubChem CID 102526997) has the molecular formula C15H15NO2 and a molecular weight of 241.29 g/mol. Its IUPAC name is 2-(2-phenyl-3H-1,3-benzoxazol-2-yl)ethanol.

Molecular Properties

Compound Name2-(2-phenyl-3H-1,3-benzoxazol-2-yl)ethanol
PubChem CID102526997
Molecular FormulaC15H15NO2
Molecular Weight241.29 g/mol
Exact Mass241.11
IUPAC Name2-(2-phenyl-3H-1,3-benzoxazol-2-yl)ethanol
SMILESOCCC1(c2ccccc2)Nc2ccccc2O1
InChIInChI=1S/C15H15NO2/c17-11-10-15(12-6-2-1-3-7-12)16-13-8-4-5-9-14(13)18-15/h1-9,16-17H,10-11H2
InChIKeyLYQZQSQNFFPYJA-UHFFFAOYSA-N
XLogP2.73
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.29
LogP ≤ 52.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-phenyl-3H-1,3-benzoxazole-2-sulfonic acid
CID 88746436
2-(2-hydroxyethyl)-2-(2-phosphanyloxyethyl)-4H-1,4-benzoxazin-3-one
CID 20580605
2-ethyl-2-methyl-3H-1,3-benzoxazole;hydroiodide
CID 173373912
2-amino-3H-1,3-benzoxazole-2-sulfonamide
CID 67147247
(8R)-8-(2-hydroxyethyl)-7-oxabicyclo[4.2.0]octa-1,3,5-trien-8-ol
CID 124639588
2-ethylsulfonyl-2-propyl-3H-1,3-benzoxazole
CID 90300803
2-(2-chloroethyl)-5-methyl-2-phenyl-3H-1,3-oxazole
CID 67948494
(2S)-3'-(1-hydroxyethylidene)-6'-methylspiro[3H-1,3-benzoxazole-2,4'-pyran]-2'-one
CID 98115909
10H-phenoxazine
CID 161421901
2-iodo-2-phenyl-1,3-dihydrobenzimidazole
CID 174916571
1,2,3,4,5,6,7,8,9,10-decakis-phenylhexacyclo[4.4.0.02,5.03,9.04,8.07,10]decane
CID 132561908
N-(3-hydroxypropyl)-2-methyl-3-oxo-4H-1,4-benzoxazine-2-carboxamide
CID 75770062

Frequently Asked Questions

What is the IUPAC name of 2-(2-phenyl-3H-1,3-benzoxazol-2-yl)ethanol?
The IUPAC name of 2-(2-phenyl-3H-1,3-benzoxazol-2-yl)ethanol (CID 102526997) is 2-(2-phenyl-3H-1,3-benzoxazol-2-yl)ethanol.
What is the SMILES notation for 2-(2-phenyl-3H-1,3-benzoxazol-2-yl)ethanol?
The canonical SMILES for 2-(2-phenyl-3H-1,3-benzoxazol-2-yl)ethanol is OCCC1(c2ccccc2)Nc2ccccc2O1.
What is the InChIKey of 2-(2-phenyl-3H-1,3-benzoxazol-2-yl)ethanol?
The InChIKey is LYQZQSQNFFPYJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15NO2/c17-11-10-15(12-6-2-1-3-7-12)16-13-8-4-5-9-14(13)18-15/h1-9,16-17H,10-11H2.
What are the key properties of 2-(2-phenyl-3H-1,3-benzoxazol-2-yl)ethanol?
2-(2-phenyl-3H-1,3-benzoxazol-2-yl)ethanol has a molecular weight of 241.29 g/mol, XLogP of 2.73, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-phenyl-3H-1,3-benzoxazol-2-yl)ethanol is sourced from PubChem (CID 102526997), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).