1-methoxyethanamine

C3H9NO — CID 19353429

IUPAC1-methoxyethanamine
SMILESCOC(C)N
InChIInChI=1S/C3H9NO/c1-3(4)5-2/h3H,4H2,1-2H3
InChIKeyMHVSMFDBVMPRGT-UHFFFAOYSA-N
MW75.11 g/mol
LogP-0.06
Rot. Bonds1

About 1-methoxyethanamine

1-methoxyethanamine (PubChem CID 19353429) has the molecular formula C3H9NO and a molecular weight of 75.11 g/mol. Its IUPAC name is 1-methoxyethanamine.

Molecular Properties

Compound Name1-methoxyethanamine
PubChem CID19353429
Molecular FormulaC3H9NO
Molecular Weight75.11 g/mol
Exact Mass75.07
IUPAC Name1-methoxyethanamine
SMILESCOC(C)N
InChIInChI=1S/C3H9NO/c1-3(4)5-2/h3H,4H2,1-2H3
InChIKeyMHVSMFDBVMPRGT-UHFFFAOYSA-N
XLogP-0.06
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50075.11
LogP ≤ 5-0.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

formic acid;1-methoxyethanamine
CID 87579928
1-methoxyethanamine;2-oxopropanoic acid
CID 174574648
2,3-dihydroxybutanedioic acid;bis(1-methoxyethanamine)
CID 174560140
amino(trimethoxy)phosphanium
CID 87744644
1,2-dimethoxypropan-1-amine
CID 23227937
amino-methoxy-dimethylphosphanium perchlorate
CID 88845158
butanoic acid;1-methoxyethanamine
CID 174560257
1-methoxyethanamine;2,2,3,3,3-pentafluoropropanoic acid
CID 174560445
2-hydroxybutanedioic acid;1-methoxyethanamine
CID 174560192
2-hydroxybutanedioic acid;bis(1-methoxyethanamine)
CID 174560190
1-methoxyethylphosphane
CID 18189169
1-[2-(1-aminoethoxy)ethenoxy]ethanamine
CID 90876183

Frequently Asked Questions

What is the IUPAC name of 1-methoxyethanamine?
The IUPAC name of 1-methoxyethanamine (CID 19353429) is 1-methoxyethanamine.
What is the SMILES notation for 1-methoxyethanamine?
The canonical SMILES for 1-methoxyethanamine is COC(C)N.
What is the InChIKey of 1-methoxyethanamine?
The InChIKey is MHVSMFDBVMPRGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H9NO/c1-3(4)5-2/h3H,4H2,1-2H3.
What are the key properties of 1-methoxyethanamine?
1-methoxyethanamine has a molecular weight of 75.11 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 1-methoxyethanamine is sourced from PubChem (CID 19353429), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).