Dioxaziridine
HNO₂·47.014 g/mol·CID 18913471
IUPAC: dioxaziridine
Also known as: Azadioxocyclopropane, 67394-35-8, SCHEMBL1680197, DTXSID80596416
Molecular Structure
Molecular Propertiesmass · H-bonds · stereo
Molecular Weight
47.014g/mol
Exact Mass
47.000728Da
Monoisotopic Mass
47.000728Da
XLogP
-0.1
Polar Surface Area
42.1Ų
Complexity
10
Formal Charge
0
H-Bond Donors
1
H-Bond Acceptors
2
Rotatable Bonds
0
Heavy Atoms
3
Stereo Centers
0
Bond Stereo
0
Drug-Likeness (Lipinski's Rule of Five)
✓ 47.0 g/mol
MW ≤ 500
✓ -0.1
LogP ≤ 5
✓ 1
H-bond donors ≤ 5
✓ 2
H-bond acceptors ≤ 10
Passes all rules — good oral bioavailability predicted
Isomers8 compounds with formula HNO₂
nitrous acid
CID 24529 · 47.0 g/mol
hydron nitrite
CID 173080259 · 47.0 g/mol
hydroxyoxoniumylideneazanide
CID 57470747 · 47.0 g/mol
CID 20336214
CID 20336214 · 47.0 g/mol
CID 177839623
CID 177839623 · 47.0 g/mol
CID 131857544
CID 131857544 · 48.0 g/mol
deuterio nitrite
CID 140787446 · 48.0 g/mol
CID 131870869
CID 131870869 · 51.0 g/mol