[1,2,5]oxadiazolo[3,4-g]quinoxaline

C8H4N4O — CID 45121557

IUPAC[1,2,5]oxadiazolo[3,4-g]quinoxaline
SMILESc1cnc2cc3nonc3cc2n1
InChIInChI=1S/C8H4N4O/c1-2-10-6-4-8-7(11-13-12-8)3-5(6)9-1/h1-4H
InChIKeyAFPAWAIGEVKKOI-UHFFFAOYSA-N
MW172.15 g/mol
LogP1.17
Rot. Bonds

About [1,2,5]oxadiazolo[3,4-g]quinoxaline

[1,2,5]oxadiazolo[3,4-g]quinoxaline (PubChem CID 45121557) has the molecular formula C8H4N4O and a molecular weight of 172.15 g/mol. Its IUPAC name is [1,2,5]oxadiazolo[3,4-g]quinoxaline.

Molecular Properties

Compound Name[1,2,5]oxadiazolo[3,4-g]quinoxaline
PubChem CID45121557
Molecular FormulaC8H4N4O
Molecular Weight172.15 g/mol
Exact Mass172.04
IUPAC Name[1,2,5]oxadiazolo[3,4-g]quinoxaline
SMILESc1cnc2cc3nonc3cc2n1
InChIInChI=1S/C8H4N4O/c1-2-10-6-4-8-7(11-13-12-8)3-5(6)9-1/h1-4H
InChIKeyAFPAWAIGEVKKOI-UHFFFAOYSA-N
XLogP1.17
TPSA64.70 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.15
LogP ≤ 51.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of [1,2,5]oxadiazolo[3,4-g]quinoxaline?
The IUPAC name of [1,2,5]oxadiazolo[3,4-g]quinoxaline (CID 45121557) is [1,2,5]oxadiazolo[3,4-g]quinoxaline.
What is the SMILES notation for [1,2,5]oxadiazolo[3,4-g]quinoxaline?
The canonical SMILES for [1,2,5]oxadiazolo[3,4-g]quinoxaline is c1cnc2cc3nonc3cc2n1.
What is the InChIKey of [1,2,5]oxadiazolo[3,4-g]quinoxaline?
The InChIKey is AFPAWAIGEVKKOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H4N4O/c1-2-10-6-4-8-7(11-13-12-8)3-5(6)9-1/h1-4H.
What are the key properties of [1,2,5]oxadiazolo[3,4-g]quinoxaline?
[1,2,5]oxadiazolo[3,4-g]quinoxaline has a molecular weight of 172.15 g/mol, XLogP of 1.17, 0 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1,2,5]oxadiazolo[3,4-g]quinoxaline is sourced from PubChem (CID 45121557), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).