2-methoxyethenamine

C3H7NO — CID 154070351

IUPAC2-methoxyethenamine
SMILESCOC=CN
InChIInChI=1S/C3H7NO/c1-5-3-2-4/h2-3H,4H2,1H3
InChIKeyVPRFUEHEHVTLLW-UHFFFAOYSA-N
MW73.10 g/mol
LogP0.06
Rot. Bonds1

About 2-methoxyethenamine

2-methoxyethenamine (PubChem CID 154070351) has the molecular formula C3H7NO and a molecular weight of 73.10 g/mol. Its IUPAC name is 2-methoxyethenamine.

Molecular Properties

Compound Name2-methoxyethenamine
PubChem CID154070351
Molecular FormulaC3H7NO
Molecular Weight73.10 g/mol
Exact Mass73.05
IUPAC Name2-methoxyethenamine
SMILESCOC=CN
InChIInChI=1S/C3H7NO/c1-5-3-2-4/h2-3H,4H2,1H3
InChIKeyVPRFUEHEHVTLLW-UHFFFAOYSA-N
XLogP0.06
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50073.10
LogP ≤ 50.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}

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Related Compounds

(E)-2-methylperoxyethenamine
CID 155769505
1,8-dimethoxyocta-1,3,5,7-tetraene
CID 163444931
(E)-1-iodo-2-methoxyethene
CID 140517862
but-2-ene;1-methoxyprop-1-ene
CID 91394801
cyclohexane;2-[methoxy(methyl)amino]oxyethenamine
CID 174826970
(E)-2-[2-[(E)-2-aminoethenoxy]ethoxy]ethenamine
CID 87183157
(Z)-4-deuterio-1-methoxybut-1-en-3-yne
CID 15620947
(Z)-1-methoxybut-1-ene
CID 5366227
ethane;(1Z)-1-methoxybuta-1,3-diene
CID 143380385
(1E,3E,5E,7E)-1-methoxynona-1,3,5,7-tetraene
CID 6440136
benzene;1-methoxyprop-1-ene
CID 158604607
(Z)-2-methoxy-N-methylethenamine
CID 59786651

Frequently Asked Questions

What is the IUPAC name of 2-methoxyethenamine?
The IUPAC name of 2-methoxyethenamine (CID 154070351) is 2-methoxyethenamine.
What is the SMILES notation for 2-methoxyethenamine?
The canonical SMILES for 2-methoxyethenamine is COC=CN.
What is the InChIKey of 2-methoxyethenamine?
The InChIKey is VPRFUEHEHVTLLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H7NO/c1-5-3-2-4/h2-3H,4H2,1H3.
What are the key properties of 2-methoxyethenamine?
2-methoxyethenamine has a molecular weight of 73.10 g/mol, XLogP of 0.06, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxyethenamine is sourced from PubChem (CID 154070351), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).