dimethylamino-dimethoxy-methylazanium

C5H15N2O2+ — CID 163977222

IUPACdimethylamino-dimethoxy-methylazanium
SMILESCO[N+](C)(OC)N(C)C
InChIInChI=1S/C5H15N2O2/c1-6(2)7(3,8-4)9-5/h1-5H3/q+1
InChIKeyGNUXSHPYTPLUAQ-UHFFFAOYSA-N
MW135.19 g/mol
LogP0.03
Rot. Bonds3

About dimethylamino-dimethoxy-methylazanium

dimethylamino-dimethoxy-methylazanium (PubChem CID 163977222) has the molecular formula C5H15N2O2+ and a molecular weight of 135.19 g/mol. Its IUPAC name is dimethylamino-dimethoxy-methylazanium.

Molecular Properties

Compound Namedimethylamino-dimethoxy-methylazanium
PubChem CID163977222
Molecular FormulaC5H15N2O2+
Molecular Weight135.19 g/mol
Exact Mass135.11
IUPAC Namedimethylamino-dimethoxy-methylazanium
SMILESCO[N+](C)(OC)N(C)C
InChIInChI=1S/C5H15N2O2/c1-6(2)7(3,8-4)9-5/h1-5H3/q+1
InChIKeyGNUXSHPYTPLUAQ-UHFFFAOYSA-N
XLogP0.03
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500135.19
LogP ≤ 50.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of dimethylamino-dimethoxy-methylazanium?
The IUPAC name of dimethylamino-dimethoxy-methylazanium (CID 163977222) is dimethylamino-dimethoxy-methylazanium.
What is the SMILES notation for dimethylamino-dimethoxy-methylazanium?
The canonical SMILES for dimethylamino-dimethoxy-methylazanium is CO[N+](C)(OC)N(C)C.
What is the InChIKey of dimethylamino-dimethoxy-methylazanium?
The InChIKey is GNUXSHPYTPLUAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H15N2O2/c1-6(2)7(3,8-4)9-5/h1-5H3/q+1.
What are the key properties of dimethylamino-dimethoxy-methylazanium?
dimethylamino-dimethoxy-methylazanium has a molecular weight of 135.19 g/mol, XLogP of 0.03, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for dimethylamino-dimethoxy-methylazanium is sourced from PubChem (CID 163977222), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).