2-(2-methylphenyl)-1,3-benzoxazol-7-ol

C14H11NO2 — CID 84689691

IUPAC2-(2-methylphenyl)-1,3-benzoxazol-7-ol
SMILESCc1ccccc1-c1nc2cccc(O)c2o1
InChIInChI=1S/C14H11NO2/c1-9-5-2-3-6-10(9)14-15-11-7-4-8-12(16)13(11)17-14/h2-8,16H,1H3
InChIKeyNNPLTTVEMBNXPH-UHFFFAOYSA-N
MW225.25 g/mol
LogP3.51
Rot. Bonds1

About 2-(2-methylphenyl)-1,3-benzoxazol-7-ol

2-(2-methylphenyl)-1,3-benzoxazol-7-ol (PubChem CID 84689691) has the molecular formula C14H11NO2 and a molecular weight of 225.25 g/mol. Its IUPAC name is 2-(2-methylphenyl)-1,3-benzoxazol-7-ol.

Molecular Properties

Compound Name2-(2-methylphenyl)-1,3-benzoxazol-7-ol
PubChem CID84689691
Molecular FormulaC14H11NO2
Molecular Weight225.25 g/mol
Exact Mass225.08
IUPAC Name2-(2-methylphenyl)-1,3-benzoxazol-7-ol
SMILESCc1ccccc1-c1nc2cccc(O)c2o1
InChIInChI=1S/C14H11NO2/c1-9-5-2-3-6-10(9)14-15-11-7-4-8-12(16)13(11)17-14/h2-8,16H,1H3
InChIKeyNNPLTTVEMBNXPH-UHFFFAOYSA-N
XLogP3.51
TPSA46.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.25
LogP ≤ 53.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-fluoro-3-methylphenyl)-1,3-benzoxazole-7-carboxylic acid
CID 81479408
7-bromo-5-methyl-2-(2-methylphenyl)-1,3-benzoxazole
CID 51983742
7-methyl-2-(4-phenylphenyl)-1,3-benzoxazole
CID 15259011
7-bromo-5-methoxy-2-(2-methylphenyl)-1,3-benzoxazole
CID 50849295
4-bromo-2-[5-(2-methylphenyl)-1,3,4-oxadiazol-2-yl]phenol
CID 155569508
5-methyl-2-(2-methylphenyl)-1,3-benzoxazole
CID 839364
5-(7-methyl-1,3-benzoxazol-2-yl)-2-propan-2-ylphenol
CID 171512133
2-chloro-1,3-benzoxazol-7-ol
CID 18967117
[2-(2-methylphenyl)-1,3-benzoxazol-5-yl]methanol
CID 82357845
bis(2-(1,3-benzoxazol-2-yl)phenol);ytterbium
CID 157356181
2-(2-benzofuran-1-yl)-7-methyl-1,3-benzoxazole
CID 57321541
2-(2-methylphenyl)-1,3-benzoxazol-6-amine
CID 6457922

Frequently Asked Questions

What is the IUPAC name of 2-(2-methylphenyl)-1,3-benzoxazol-7-ol?
The IUPAC name of 2-(2-methylphenyl)-1,3-benzoxazol-7-ol (CID 84689691) is 2-(2-methylphenyl)-1,3-benzoxazol-7-ol.
What is the SMILES notation for 2-(2-methylphenyl)-1,3-benzoxazol-7-ol?
The canonical SMILES for 2-(2-methylphenyl)-1,3-benzoxazol-7-ol is Cc1ccccc1-c1nc2cccc(O)c2o1.
What is the InChIKey of 2-(2-methylphenyl)-1,3-benzoxazol-7-ol?
The InChIKey is NNPLTTVEMBNXPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11NO2/c1-9-5-2-3-6-10(9)14-15-11-7-4-8-12(16)13(11)17-14/h2-8,16H,1H3.
What are the key properties of 2-(2-methylphenyl)-1,3-benzoxazol-7-ol?
2-(2-methylphenyl)-1,3-benzoxazol-7-ol has a molecular weight of 225.25 g/mol, XLogP of 3.51, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methylphenyl)-1,3-benzoxazol-7-ol is sourced from PubChem (CID 84689691), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).