5-(dioxaziridin-3-yl)quinolin-8-ol

C9H6N2O3 — CID 51371084

IUPAC5-(dioxaziridin-3-yl)quinolin-8-ol
SMILESOc1ccc(-n2oo2)c2cccnc12
InChIInChI=1S/C9H6N2O3/c12-8-4-3-7(11-13-14-11)6-2-1-5-10-9(6)8/h1-5,12H
InChIKeyHKBDIJRTXJUIIA-UHFFFAOYSA-N
MW190.16 g/mol
LogP1.92
Rot. Bonds1

About 5-(dioxaziridin-3-yl)quinolin-8-ol

5-(dioxaziridin-3-yl)quinolin-8-ol (PubChem CID 51371084) has the molecular formula C9H6N2O3 and a molecular weight of 190.16 g/mol. Its IUPAC name is 5-(dioxaziridin-3-yl)quinolin-8-ol.

Molecular Properties

Compound Name5-(dioxaziridin-3-yl)quinolin-8-ol
PubChem CID51371084
Molecular FormulaC9H6N2O3
Molecular Weight190.16 g/mol
Exact Mass190.04
IUPAC Name5-(dioxaziridin-3-yl)quinolin-8-ol
SMILESOc1ccc(-n2oo2)c2cccnc12
InChIInChI=1S/C9H6N2O3/c12-8-4-3-7(11-13-14-11)6-2-1-5-10-9(6)8/h1-5,12H
InChIKeyHKBDIJRTXJUIIA-UHFFFAOYSA-N
XLogP1.92
TPSA64.33 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.16
LogP ≤ 51.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-(dioxaziridin-3-yl)quinolin-8-ol?
The IUPAC name of 5-(dioxaziridin-3-yl)quinolin-8-ol (CID 51371084) is 5-(dioxaziridin-3-yl)quinolin-8-ol.
What is the SMILES notation for 5-(dioxaziridin-3-yl)quinolin-8-ol?
The canonical SMILES for 5-(dioxaziridin-3-yl)quinolin-8-ol is Oc1ccc(-n2oo2)c2cccnc12.
What is the InChIKey of 5-(dioxaziridin-3-yl)quinolin-8-ol?
The InChIKey is HKBDIJRTXJUIIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H6N2O3/c12-8-4-3-7(11-13-14-11)6-2-1-5-10-9(6)8/h1-5,12H.
What are the key properties of 5-(dioxaziridin-3-yl)quinolin-8-ol?
5-(dioxaziridin-3-yl)quinolin-8-ol has a molecular weight of 190.16 g/mol, XLogP of 1.92, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(dioxaziridin-3-yl)quinolin-8-ol is sourced from PubChem (CID 51371084), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).