[[[azanidyl(methyl)amino]-methoxymethyl]-methylamino]azanide

C4H12N4O-2 — CID 163646166

IUPAC[[[azanidyl(methyl)amino]-methoxymethyl]-methylamino]azanide
SMILESCOC(N(C)[NH-])N(C)[NH-]
InChIInChI=1S/C4H12N4O/c1-7(5)4(9-3)8(2)6/h4-6H,1-3H3/q-2
InChIKeyIBCNFRPAYJULMC-UHFFFAOYSA-N
MW132.17 g/mol
LogP0.71
Rot. Bonds3

About [[[azanidyl(methyl)amino]-methoxymethyl]-methylamino]azanide

[[[azanidyl(methyl)amino]-methoxymethyl]-methylamino]azanide (PubChem CID 163646166) has the molecular formula C4H12N4O-2 and a molecular weight of 132.17 g/mol. Its IUPAC name is [[[azanidyl(methyl)amino]-methoxymethyl]-methylamino]azanide.

Molecular Properties

Compound Name[[[azanidyl(methyl)amino]-methoxymethyl]-methylamino]azanide
PubChem CID163646166
Molecular FormulaC4H12N4O-2
Molecular Weight132.17 g/mol
Exact Mass132.10
IUPAC Name[[[azanidyl(methyl)amino]-methoxymethyl]-methylamino]azanide
SMILESCOC(N(C)[NH-])N(C)[NH-]
InChIInChI=1S/C4H12N4O/c1-7(5)4(9-3)8(2)6/h4-6H,1-3H3/q-2
InChIKeyIBCNFRPAYJULMC-UHFFFAOYSA-N
XLogP0.71
TPSA63.31 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500132.17
LogP ≤ 50.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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 [[[azanidyl(methyl)amino]-methoxymethyl]-methylamino]azanide?
The IUPAC name of [[[azanidyl(methyl)amino]-methoxymethyl]-methylamino]azanide (CID 163646166) is [[[azanidyl(methyl)amino]-methoxymethyl]-methylamino]azanide.
What is the SMILES notation for [[[azanidyl(methyl)amino]-methoxymethyl]-methylamino]azanide?
The canonical SMILES for [[[azanidyl(methyl)amino]-methoxymethyl]-methylamino]azanide is COC(N(C)[NH-])N(C)[NH-].
What is the InChIKey of [[[azanidyl(methyl)amino]-methoxymethyl]-methylamino]azanide?
The InChIKey is IBCNFRPAYJULMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H12N4O/c1-7(5)4(9-3)8(2)6/h4-6H,1-3H3/q-2.
What are the key properties of [[[azanidyl(methyl)amino]-methoxymethyl]-methylamino]azanide?
[[[azanidyl(methyl)amino]-methoxymethyl]-methylamino]azanide has a molecular weight of 132.17 g/mol, XLogP of 0.71, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [[[azanidyl(methyl)amino]-methoxymethyl]-methylamino]azanide is sourced from PubChem (CID 163646166), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).