2-(2,3-dihydro-1-benzofuran-4-yl)-2,3-dihydro-1,3-benzoxazole

C15H13NO2 — CID 166716951

IUPAC2-(2,3-dihydro-1-benzofuran-4-yl)-2,3-dihydro-1,3-benzoxazole
SMILESc1ccc2c(c1)NC(c1cccc3c1CCO3)O2
InChIInChI=1S/C15H13NO2/c1-2-6-14-12(5-1)16-15(18-14)11-4-3-7-13-10(11)8-9-17-13/h1-7,15-16H,8-9H2
InChIKeyPZXABBZOYALSLU-UHFFFAOYSA-N
MW239.27 g/mol
LogP3.12
Rot. Bonds1

About 2-(2,3-dihydro-1-benzofuran-4-yl)-2,3-dihydro-1,3-benzoxazole

2-(2,3-dihydro-1-benzofuran-4-yl)-2,3-dihydro-1,3-benzoxazole (PubChem CID 166716951) has the molecular formula C15H13NO2 and a molecular weight of 239.27 g/mol. Its IUPAC name is 2-(2,3-dihydro-1-benzofuran-4-yl)-2,3-dihydro-1,3-benzoxazole.

Molecular Properties

Compound Name2-(2,3-dihydro-1-benzofuran-4-yl)-2,3-dihydro-1,3-benzoxazole
PubChem CID166716951
Molecular FormulaC15H13NO2
Molecular Weight239.27 g/mol
Exact Mass239.09
IUPAC Name2-(2,3-dihydro-1-benzofuran-4-yl)-2,3-dihydro-1,3-benzoxazole
SMILESc1ccc2c(c1)NC(c1cccc3c1CCO3)O2
InChIInChI=1S/C15H13NO2/c1-2-6-14-12(5-1)16-15(18-14)11-4-3-7-13-10(11)8-9-17-13/h1-7,15-16H,8-9H2
InChIKeyPZXABBZOYALSLU-UHFFFAOYSA-N
XLogP3.12
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.27
LogP ≤ 53.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[4-(2,3-dihydro-1,3-benzoxazol-2-yl)phenyl]-2,3-dihydro-1,3-benzoxazole
CID 66584986
(3R)-3-(2,3-dihydro-1-benzofuran-4-yl)piperidine
CID 96763066
(2R)-2-(3,4-dihydro-2H-chromen-5-yl)azetidine
CID 131172256
[2-(2,3-dihydro-1-benzofuran-4-yl)cyclopropyl]methanamine
CID 18787377
4-(2,3-dihydro-1-benzofuran-4-yl)-1-ethylpiperidine
CID 123608868
3-chloro-4-[(2S)-2,3-dihydro-1,3-benzoxazol-2-yl]-N,N-dimethylaniline
CID 6929827
[2-(2,3-dihydro-1-benzofuran-4-yl)cyclopropyl]methanediol
CID 123498759
(2S)-5-chloro-2-(2-chlorophenyl)-2,3-dihydro-1,3-benzoxazole
CID 6929834
5-[(1R,3R)-3-(2,3-dihydro-1-benzofuran-4-yl)-2,2-dimethylcyclopropyl]-2-methylsulfanyl-4,5-dihydro-1H-imidazole
CID 71129727
2-[2-(2,3-dihydro-1-benzofuran-4-yl)cyclopropyl]acetamide
CID 123181605
2-[2-(2,3-dihydro-1-benzofuran-4-yl)-5-methylpiperidin-1-yl]-2-oxoacetamide
CID 169114422
2-[3-(4-naphthalen-2-yl-1,2,3,4-tetrahydroquinazolin-2-yl)phenyl]-2,3-dihydro-1,3-benzoxazole
CID 145202402

Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dihydro-1-benzofuran-4-yl)-2,3-dihydro-1,3-benzoxazole?
The IUPAC name of 2-(2,3-dihydro-1-benzofuran-4-yl)-2,3-dihydro-1,3-benzoxazole (CID 166716951) is 2-(2,3-dihydro-1-benzofuran-4-yl)-2,3-dihydro-1,3-benzoxazole.
What is the SMILES notation for 2-(2,3-dihydro-1-benzofuran-4-yl)-2,3-dihydro-1,3-benzoxazole?
The canonical SMILES for 2-(2,3-dihydro-1-benzofuran-4-yl)-2,3-dihydro-1,3-benzoxazole is c1ccc2c(c1)NC(c1cccc3c1CCO3)O2.
What is the InChIKey of 2-(2,3-dihydro-1-benzofuran-4-yl)-2,3-dihydro-1,3-benzoxazole?
The InChIKey is PZXABBZOYALSLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13NO2/c1-2-6-14-12(5-1)16-15(18-14)11-4-3-7-13-10(11)8-9-17-13/h1-7,15-16H,8-9H2.
What are the key properties of 2-(2,3-dihydro-1-benzofuran-4-yl)-2,3-dihydro-1,3-benzoxazole?
2-(2,3-dihydro-1-benzofuran-4-yl)-2,3-dihydro-1,3-benzoxazole has a molecular weight of 239.27 g/mol, XLogP of 3.12, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dihydro-1-benzofuran-4-yl)-2,3-dihydro-1,3-benzoxazole is sourced from PubChem (CID 166716951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).