2-fluoro-N-methoxyethanamine

C3H8FNO — CID 80697262

IUPAC2-fluoro-N-methoxyethanamine
SMILESCONCCF
InChIInChI=1S/C3H8FNO/c1-6-5-3-2-4/h5H,2-3H2,1H3
InChIKeyVMRAVKRBJKINJM-UHFFFAOYSA-N
MW93.10 g/mol
LogP0.11
Rot. Bonds3

About 2-fluoro-N-methoxyethanamine

2-fluoro-N-methoxyethanamine (PubChem CID 80697262) has the molecular formula C3H8FNO and a molecular weight of 93.10 g/mol. Its IUPAC name is 2-fluoro-N-methoxyethanamine.

Molecular Properties

Compound Name2-fluoro-N-methoxyethanamine
PubChem CID80697262
Molecular FormulaC3H8FNO
Molecular Weight93.10 g/mol
Exact Mass93.06
IUPAC Name2-fluoro-N-methoxyethanamine
SMILESCONCCF
InChIInChI=1S/C3H8FNO/c1-6-5-3-2-4/h5H,2-3H2,1H3
InChIKeyVMRAVKRBJKINJM-UHFFFAOYSA-N
XLogP0.11
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50093.10
LogP ≤ 50.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

Ethyl(methoxy)amine hydrochloride
CID 22613948
Ethyl(methoxy)amine
CID 14975831
2,2-difluoro-N-methoxyethanamine
CID 57444894
3,3,3-trifluoro-N-methoxypropan-1-amine
CID 64973781
N-(3-fluoropropoxy)ethanamine
CID 89303756
N-ethoxy-2-fluoroethanamine
CID 80697402
3-fluoro-N-methoxypropan-1-amine
CID 81106951
N-ethoxy-3-fluoropropan-1-amine
CID 81107073
2-fluoro-N-methoxybutan-1-amine
CID 130725720
3-fluoro-N-propoxypropan-1-amine
CID 131054232
CID 17866079
CID 17866079
N-methanidyloxyethanamine;rutherfordium
CID 58444276

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-N-methoxyethanamine?
The IUPAC name of 2-fluoro-N-methoxyethanamine (CID 80697262) is 2-fluoro-N-methoxyethanamine.
What is the SMILES notation for 2-fluoro-N-methoxyethanamine?
The canonical SMILES for 2-fluoro-N-methoxyethanamine is CONCCF.
What is the InChIKey of 2-fluoro-N-methoxyethanamine?
The InChIKey is VMRAVKRBJKINJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H8FNO/c1-6-5-3-2-4/h5H,2-3H2,1H3.
What are the key properties of 2-fluoro-N-methoxyethanamine?
2-fluoro-N-methoxyethanamine has a molecular weight of 93.10 g/mol, XLogP of 0.11, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-N-methoxyethanamine is sourced from PubChem (CID 80697262), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).