furo[2,3-e][1,2]benzoxazole

C9H5NO2 — CID 57375713

IUPACfuro[2,3-e][1,2]benzoxazole
SMILESc1cc2ccc3oncc3c2o1
InChIInChI=1S/C9H5NO2/c1-2-8-7(5-10-12-8)9-6(1)3-4-11-9/h1-5H
InChIKeyRMSXXPDDXINLRM-UHFFFAOYSA-N
MW159.14 g/mol
LogP2.57
Rot. Bonds

About furo[2,3-e][1,2]benzoxazole

furo[2,3-e][1,2]benzoxazole (PubChem CID 57375713) has the molecular formula C9H5NO2 and a molecular weight of 159.14 g/mol. Its IUPAC name is furo[2,3-e][1,2]benzoxazole.

Molecular Properties

Compound Namefuro[2,3-e][1,2]benzoxazole
PubChem CID57375713
Molecular FormulaC9H5NO2
Molecular Weight159.14 g/mol
Exact Mass159.03
IUPAC Namefuro[2,3-e][1,2]benzoxazole
SMILESc1cc2ccc3oncc3c2o1
InChIInChI=1S/C9H5NO2/c1-2-8-7(5-10-12-8)9-6(1)3-4-11-9/h1-5H
InChIKeyRMSXXPDDXINLRM-UHFFFAOYSA-N
XLogP2.57
TPSA39.17 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.14
LogP ≤ 52.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

[1]benzofuro[7,6-h]chromen-8-one
CID 57357836
4-fluoro-1,2-benzoxazol-5-amine
CID 84649584
7-bromo-1-benzofuran-6-ol
CID 83681550
7-amino-1-benzofuran-6-ol
CID 83914018
4-ethyl-[1,2]oxazolo[4,5-c]pyridine
CID 122697261
ethane;6-propan-2-ylfuro[2,3-f]isoquinoline
CID 143166928
1-benzofuran-6,7-dithiol
CID 167495645
5-methoxy-1,2-benzoxazol-4-amine
CID 117109992
benzo[g][1]benzofuran-5-amine
CID 141105046
5-phenylbenzo[g][1]benzofuran
CID 12588747
4-bromo-1,2-benzoxazole-5-carboxylic acid
CID 117109886
4-prop-2-enyl-1,2-benzoxazole
CID 173364606

Frequently Asked Questions

What is the IUPAC name of furo[2,3-e][1,2]benzoxazole?
The IUPAC name of furo[2,3-e][1,2]benzoxazole (CID 57375713) is furo[2,3-e][1,2]benzoxazole.
What is the SMILES notation for furo[2,3-e][1,2]benzoxazole?
The canonical SMILES for furo[2,3-e][1,2]benzoxazole is c1cc2ccc3oncc3c2o1.
What is the InChIKey of furo[2,3-e][1,2]benzoxazole?
The InChIKey is RMSXXPDDXINLRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H5NO2/c1-2-8-7(5-10-12-8)9-6(1)3-4-11-9/h1-5H.
What are the key properties of furo[2,3-e][1,2]benzoxazole?
furo[2,3-e][1,2]benzoxazole has a molecular weight of 159.14 g/mol, XLogP of 2.57, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for furo[2,3-e][1,2]benzoxazole is sourced from PubChem (CID 57375713), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).