methane;2-methoxy-N-methylethanamine

C5H15NO — CID 159300149

IUPACmethane;2-methoxy-N-methylethanamine
SMILESC.CNCCOC
InChIInChI=1S/C4H11NO.CH4/c1-5-3-4-6-2;/h5H,3-4H2,1-2H3;1H4
InChIKeyLBFPHXSKGJYXRM-UHFFFAOYSA-N
MW105.18 g/mol
LogP0.49
Rot. Bonds3

About methane;2-methoxy-N-methylethanamine

methane;2-methoxy-N-methylethanamine (PubChem CID 159300149) has the molecular formula C5H15NO and a molecular weight of 105.18 g/mol. Its IUPAC name is methane;2-methoxy-N-methylethanamine.

Molecular Properties

Compound Namemethane;2-methoxy-N-methylethanamine
PubChem CID159300149
Molecular FormulaC5H15NO
Molecular Weight105.18 g/mol
Exact Mass105.12
IUPAC Namemethane;2-methoxy-N-methylethanamine
SMILESC.CNCCOC
InChIInChI=1S/C4H11NO.CH4/c1-5-3-4-6-2;/h5H,3-4H2,1-2H3;1H4
InChIKeyLBFPHXSKGJYXRM-UHFFFAOYSA-N
XLogP0.49
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms7
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500105.18
LogP ≤ 50.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of methane;2-methoxy-N-methylethanamine?
The IUPAC name of methane;2-methoxy-N-methylethanamine (CID 159300149) is methane;2-methoxy-N-methylethanamine.
What is the SMILES notation for methane;2-methoxy-N-methylethanamine?
The canonical SMILES for methane;2-methoxy-N-methylethanamine is C.CNCCOC.
What is the InChIKey of methane;2-methoxy-N-methylethanamine?
The InChIKey is LBFPHXSKGJYXRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H11NO.CH4/c1-5-3-4-6-2;/h5H,3-4H2,1-2H3;1H4.
What are the key properties of methane;2-methoxy-N-methylethanamine?
methane;2-methoxy-N-methylethanamine has a molecular weight of 105.18 g/mol, XLogP of 0.49, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for methane;2-methoxy-N-methylethanamine is sourced from PubChem (CID 159300149), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).