N-[2-[hydroxy(oxido)amino]-1-methoxypropan-2-yl]-N-oxidohydroxylamine

C4H10N2O5-2 — CID 89155720

IUPACN-[2-[hydroxy(oxido)amino]-1-methoxypropan-2-yl]-N-oxidohydroxylamine
SMILESCOCC(C)(N([O-])O)N([O-])O
InChIInChI=1S/C4H10N2O5/c1-4(3-11-2,5(7)8)6(9)10/h7,9H,3H2,1-2H3/q-2
InChIKeyUGUATRIWZFFTSY-UHFFFAOYSA-N
MW166.13 g/mol
LogP-0.27
Rot. Bonds4

About N-[2-[hydroxy(oxido)amino]-1-methoxypropan-2-yl]-N-oxidohydroxylamine

N-[2-[hydroxy(oxido)amino]-1-methoxypropan-2-yl]-N-oxidohydroxylamine (PubChem CID 89155720) has the molecular formula C4H10N2O5-2 and a molecular weight of 166.13 g/mol. Its IUPAC name is N-[2-[hydroxy(oxido)amino]-1-methoxypropan-2-yl]-N-oxidohydroxylamine.

Molecular Properties

Compound NameN-[2-[hydroxy(oxido)amino]-1-methoxypropan-2-yl]-N-oxidohydroxylamine
PubChem CID89155720
Molecular FormulaC4H10N2O5-2
Molecular Weight166.13 g/mol
Exact Mass166.06
IUPAC NameN-[2-[hydroxy(oxido)amino]-1-methoxypropan-2-yl]-N-oxidohydroxylamine
SMILESCOCC(C)(N([O-])O)N([O-])O
InChIInChI=1S/C4H10N2O5/c1-4(3-11-2,5(7)8)6(9)10/h7,9H,3H2,1-2H3/q-2
InChIKeyUGUATRIWZFFTSY-UHFFFAOYSA-N
XLogP-0.27
TPSA102.29 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.13
LogP ≤ 5-0.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-[2-[hydroxy(oxido)amino]-1-methoxypropan-2-yl]-N-oxidohydroxylamine?
The IUPAC name of N-[2-[hydroxy(oxido)amino]-1-methoxypropan-2-yl]-N-oxidohydroxylamine (CID 89155720) is N-[2-[hydroxy(oxido)amino]-1-methoxypropan-2-yl]-N-oxidohydroxylamine.
What is the SMILES notation for N-[2-[hydroxy(oxido)amino]-1-methoxypropan-2-yl]-N-oxidohydroxylamine?
The canonical SMILES for N-[2-[hydroxy(oxido)amino]-1-methoxypropan-2-yl]-N-oxidohydroxylamine is COCC(C)(N([O-])O)N([O-])O.
What is the InChIKey of N-[2-[hydroxy(oxido)amino]-1-methoxypropan-2-yl]-N-oxidohydroxylamine?
The InChIKey is UGUATRIWZFFTSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10N2O5/c1-4(3-11-2,5(7)8)6(9)10/h7,9H,3H2,1-2H3/q-2.
What are the key properties of N-[2-[hydroxy(oxido)amino]-1-methoxypropan-2-yl]-N-oxidohydroxylamine?
N-[2-[hydroxy(oxido)amino]-1-methoxypropan-2-yl]-N-oxidohydroxylamine has a molecular weight of 166.13 g/mol, XLogP of -0.27, 4 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[hydroxy(oxido)amino]-1-methoxypropan-2-yl]-N-oxidohydroxylamine is sourced from PubChem (CID 89155720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).