(dimethoxyamino)oxymethane;methane

C4H13NO3 — CID 175558336

IUPAC(dimethoxyamino)oxymethane;methane
SMILESC.CON(OC)OC
InChIInChI=1S/C3H9NO3.CH4/c1-5-4(6-2)7-3;/h1-3H3;1H4
InChIKeyOKDXTAFJSIXACT-UHFFFAOYSA-N
MW123.15 g/mol
LogP0.61
Rot. Bonds3

About (dimethoxyamino)oxymethane;methane

(dimethoxyamino)oxymethane;methane (PubChem CID 175558336) has the molecular formula C4H13NO3 and a molecular weight of 123.15 g/mol. Its IUPAC name is (dimethoxyamino)oxymethane;methane.

Molecular Properties

Compound Name(dimethoxyamino)oxymethane;methane
PubChem CID175558336
Molecular FormulaC4H13NO3
Molecular Weight123.15 g/mol
Exact Mass123.09
IUPAC Name(dimethoxyamino)oxymethane;methane
SMILESC.CON(OC)OC
InChIInChI=1S/C3H9NO3.CH4/c1-5-4(6-2)7-3;/h1-3H3;1H4
InChIKeyOKDXTAFJSIXACT-UHFFFAOYSA-N
XLogP0.61
TPSA30.93 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500123.15
LogP ≤ 50.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (dimethoxyamino)oxymethane;methane?
The IUPAC name of (dimethoxyamino)oxymethane;methane (CID 175558336) is (dimethoxyamino)oxymethane;methane.
What is the SMILES notation for (dimethoxyamino)oxymethane;methane?
The canonical SMILES for (dimethoxyamino)oxymethane;methane is C.CON(OC)OC.
What is the InChIKey of (dimethoxyamino)oxymethane;methane?
The InChIKey is OKDXTAFJSIXACT-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H9NO3.CH4/c1-5-4(6-2)7-3;/h1-3H3;1H4.
What are the key properties of (dimethoxyamino)oxymethane;methane?
(dimethoxyamino)oxymethane;methane has a molecular weight of 123.15 g/mol, XLogP of 0.61, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (dimethoxyamino)oxymethane;methane is sourced from PubChem (CID 175558336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).