2-(aminomethoxy)-N-methylethanamine

C4H12N2O — CID 89066474

IUPAC2-(aminomethoxy)-N-methylethanamine
SMILESCNCCOCN
InChIInChI=1S/C4H12N2O/c1-6-2-3-7-4-5/h6H,2-5H2,1H3
InChIKeyZCQJCFALPNRVQH-UHFFFAOYSA-N
MW104.15 g/mol
LogP-0.86
Rot. Bonds4

About 2-(aminomethoxy)-N-methylethanamine

2-(aminomethoxy)-N-methylethanamine (PubChem CID 89066474) has the molecular formula C4H12N2O and a molecular weight of 104.15 g/mol. Its IUPAC name is 2-(aminomethoxy)-N-methylethanamine.

Molecular Properties

Compound Name2-(aminomethoxy)-N-methylethanamine
PubChem CID89066474
Molecular FormulaC4H12N2O
Molecular Weight104.15 g/mol
Exact Mass104.09
IUPAC Name2-(aminomethoxy)-N-methylethanamine
SMILESCNCCOCN
InChIInChI=1S/C4H12N2O/c1-6-2-3-7-4-5/h6H,2-5H2,1H3
InChIKeyZCQJCFALPNRVQH-UHFFFAOYSA-N
XLogP-0.86
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500104.15
LogP ≤ 5-0.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', '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 2-(aminomethoxy)-N-methylethanamine?
The IUPAC name of 2-(aminomethoxy)-N-methylethanamine (CID 89066474) is 2-(aminomethoxy)-N-methylethanamine.
What is the SMILES notation for 2-(aminomethoxy)-N-methylethanamine?
The canonical SMILES for 2-(aminomethoxy)-N-methylethanamine is CNCCOCN.
What is the InChIKey of 2-(aminomethoxy)-N-methylethanamine?
The InChIKey is ZCQJCFALPNRVQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H12N2O/c1-6-2-3-7-4-5/h6H,2-5H2,1H3.
What are the key properties of 2-(aminomethoxy)-N-methylethanamine?
2-(aminomethoxy)-N-methylethanamine has a molecular weight of 104.15 g/mol, XLogP of -0.86, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(aminomethoxy)-N-methylethanamine is sourced from PubChem (CID 89066474), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).