2-(fluoromethoxy)-N-methylethanamine

C4H10FNO — CID 122581352

IUPAC2-(fluoromethoxy)-N-methylethanamine
SMILESCNCCOCF
InChIInChI=1S/C4H10FNO/c1-6-2-3-7-4-5/h6H,2-4H2,1H3
InChIKeySFGCLFYIZPVXJU-UHFFFAOYSA-N
MW107.13 g/mol
LogP0.15
Rot. Bonds4

About 2-(fluoromethoxy)-N-methylethanamine

2-(fluoromethoxy)-N-methylethanamine (PubChem CID 122581352) has the molecular formula C4H10FNO and a molecular weight of 107.13 g/mol. Its IUPAC name is 2-(fluoromethoxy)-N-methylethanamine.

Molecular Properties

Compound Name2-(fluoromethoxy)-N-methylethanamine
PubChem CID122581352
Molecular FormulaC4H10FNO
Molecular Weight107.13 g/mol
Exact Mass107.07
IUPAC Name2-(fluoromethoxy)-N-methylethanamine
SMILESCNCCOCF
InChIInChI=1S/C4H10FNO/c1-6-2-3-7-4-5/h6H,2-4H2,1H3
InChIKeySFGCLFYIZPVXJU-UHFFFAOYSA-N
XLogP0.15
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500107.13
LogP ≤ 50.15
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 2-(fluoromethoxy)-N-methylethanamine?
The IUPAC name of 2-(fluoromethoxy)-N-methylethanamine (CID 122581352) is 2-(fluoromethoxy)-N-methylethanamine.
What is the SMILES notation for 2-(fluoromethoxy)-N-methylethanamine?
The canonical SMILES for 2-(fluoromethoxy)-N-methylethanamine is CNCCOCF.
What is the InChIKey of 2-(fluoromethoxy)-N-methylethanamine?
The InChIKey is SFGCLFYIZPVXJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10FNO/c1-6-2-3-7-4-5/h6H,2-4H2,1H3.
What are the key properties of 2-(fluoromethoxy)-N-methylethanamine?
2-(fluoromethoxy)-N-methylethanamine has a molecular weight of 107.13 g/mol, XLogP of 0.15, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(fluoromethoxy)-N-methylethanamine is sourced from PubChem (CID 122581352), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).