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

C9H5NO2 — CID 45120277

IUPACfuro[2,3-g][1,3]benzoxazole
SMILESc1cc2c(ccc3ncoc32)o1
InChIInChI=1S/C9H5NO2/c1-2-8-6(3-4-11-8)9-7(1)10-5-12-9/h1-5H
InChIKeyZZYJNUAUZDNLRL-UHFFFAOYSA-N
MW159.14 g/mol
LogP2.57
Rot. Bonds

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

furo[2,3-g][1,3]benzoxazole (PubChem CID 45120277) has the molecular formula C9H5NO2 and a molecular weight of 159.14 g/mol. Its IUPAC name is furo[2,3-g][1,3]benzoxazole.

Molecular Properties

Compound Namefuro[2,3-g][1,3]benzoxazole
PubChem CID45120277
Molecular FormulaC9H5NO2
Molecular Weight159.14 g/mol
Exact Mass159.03
IUPAC Namefuro[2,3-g][1,3]benzoxazole
SMILESc1cc2c(ccc3ncoc32)o1
InChIInChI=1S/C9H5NO2/c1-2-8-6(3-4-11-8)9-7(1)10-5-12-9/h1-5H
InChIKeyZZYJNUAUZDNLRL-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

[1,3]oxazolo[5,4-a]acridine
CID 176655511
6-oxa-11-azatricyclo[8.4.0.03,7]tetradeca-1(10),3(7),4,8,11,13-hexaen-2-one
CID 59457780
6-bromo-7-fluoro-1,3-benzoxazole
CID 122235305
7-chloro-6-methyl-1,3-benzoxazole
CID 161041002
[1]benzofuro[4,5-g]quinoline;hydrochloride
CID 68728891
4-amino-1-benzofuran-5-carbaldehyde
CID 82415504
4,6-bis([1,3]oxazolo[5,4-c]pyridin-4-yl)-[1,3]oxazolo[5,4-c]pyridine
CID 173130316
7-bromo-1,3-benzoxazole
CID 53408472
6,7-di(propan-2-yl)-1,3-benzoxazole
CID 90310296
10-chloronaphtho[2,1-g][1,3]benzoxazole
CID 162517870
4-chlorofuro[3,2-c]pyridine;ethane
CID 144953720
7-[(E)-prop-1-enyl]-1,3-benzoxazole
CID 90277918

Frequently Asked Questions

What is the IUPAC name of furo[2,3-g][1,3]benzoxazole?
The IUPAC name of furo[2,3-g][1,3]benzoxazole (CID 45120277) is furo[2,3-g][1,3]benzoxazole.
What is the SMILES notation for furo[2,3-g][1,3]benzoxazole?
The canonical SMILES for furo[2,3-g][1,3]benzoxazole is c1cc2c(ccc3ncoc32)o1.
What is the InChIKey of furo[2,3-g][1,3]benzoxazole?
The InChIKey is ZZYJNUAUZDNLRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H5NO2/c1-2-8-6(3-4-11-8)9-7(1)10-5-12-9/h1-5H.
What are the key properties of furo[2,3-g][1,3]benzoxazole?
furo[2,3-g][1,3]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-g][1,3]benzoxazole is sourced from PubChem (CID 45120277), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).