1-methoxy-1-methoxy-N,N-dimethylmethanamine

C5H12NO2+ — CID 58336844

IUPAC1-methoxy-1-methoxy-N,N-dimethylmethanamine
SMILES[CH2+]OC(OC)N(C)C
InChIInChI=1S/C5H12NO2/c1-6(2)5(7-3)8-4/h5H,3H2,1-2,4H3/q+1
InChIKeyAYDCJRZEHZCDAW-UHFFFAOYSA-N
MW118.16 g/mol
LogP0.29
Rot. Bonds3

About 1-methoxy-1-methoxy-N,N-dimethylmethanamine

1-methoxy-1-methoxy-N,N-dimethylmethanamine (PubChem CID 58336844) has the molecular formula C5H12NO2+ and a molecular weight of 118.16 g/mol. Its IUPAC name is 1-methoxy-1-methoxy-N,N-dimethylmethanamine.

Molecular Properties

Compound Name1-methoxy-1-methoxy-N,N-dimethylmethanamine
PubChem CID58336844
Molecular FormulaC5H12NO2+
Molecular Weight118.16 g/mol
Exact Mass118.09
IUPAC Name1-methoxy-1-methoxy-N,N-dimethylmethanamine
SMILES[CH2+]OC(OC)N(C)C
InChIInChI=1S/C5H12NO2/c1-6(2)5(7-3)8-4/h5H,3H2,1-2,4H3/q+1
InChIKeyAYDCJRZEHZCDAW-UHFFFAOYSA-N
XLogP0.29
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500118.16
LogP ≤ 50.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-methoxy-1-methoxy-N,N-dimethylmethanamine?
The IUPAC name of 1-methoxy-1-methoxy-N,N-dimethylmethanamine (CID 58336844) is 1-methoxy-1-methoxy-N,N-dimethylmethanamine.
What is the SMILES notation for 1-methoxy-1-methoxy-N,N-dimethylmethanamine?
The canonical SMILES for 1-methoxy-1-methoxy-N,N-dimethylmethanamine is [CH2+]OC(OC)N(C)C.
What is the InChIKey of 1-methoxy-1-methoxy-N,N-dimethylmethanamine?
The InChIKey is AYDCJRZEHZCDAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H12NO2/c1-6(2)5(7-3)8-4/h5H,3H2,1-2,4H3/q+1.
What are the key properties of 1-methoxy-1-methoxy-N,N-dimethylmethanamine?
1-methoxy-1-methoxy-N,N-dimethylmethanamine has a molecular weight of 118.16 g/mol, XLogP of 0.29, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methoxy-1-methoxy-N,N-dimethylmethanamine is sourced from PubChem (CID 58336844), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).