2-fluoro-2-methoxy-N-methylethanamine

C4H10FNO — CID 129280868

IUPAC2-fluoro-2-methoxy-N-methylethanamine
SMILESCNCC(F)OC
InChIInChI=1S/C4H10FNO/c1-6-3-4(5)7-2/h4,6H,3H2,1-2H3
InChIKeyNRKJHKBEZVWBQA-UHFFFAOYSA-N
MW107.13 g/mol
LogP0.15
Rot. Bonds3

About 2-fluoro-2-methoxy-N-methylethanamine

2-fluoro-2-methoxy-N-methylethanamine (PubChem CID 129280868) has the molecular formula C4H10FNO and a molecular weight of 107.13 g/mol. Its IUPAC name is 2-fluoro-2-methoxy-N-methylethanamine.

Molecular Properties

Compound Name2-fluoro-2-methoxy-N-methylethanamine
PubChem CID129280868
Molecular FormulaC4H10FNO
Molecular Weight107.13 g/mol
Exact Mass107.07
IUPAC Name2-fluoro-2-methoxy-N-methylethanamine
SMILESCNCC(F)OC
InChIInChI=1S/C4H10FNO/c1-6-3-4(5)7-2/h4,6H,3H2,1-2H3
InChIKeyNRKJHKBEZVWBQA-UHFFFAOYSA-N
XLogP0.15
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
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

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Frequently Asked Questions

What is the IUPAC name of 2-fluoro-2-methoxy-N-methylethanamine?
The IUPAC name of 2-fluoro-2-methoxy-N-methylethanamine (CID 129280868) is 2-fluoro-2-methoxy-N-methylethanamine.
What is the SMILES notation for 2-fluoro-2-methoxy-N-methylethanamine?
The canonical SMILES for 2-fluoro-2-methoxy-N-methylethanamine is CNCC(F)OC.
What is the InChIKey of 2-fluoro-2-methoxy-N-methylethanamine?
The InChIKey is NRKJHKBEZVWBQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10FNO/c1-6-3-4(5)7-2/h4,6H,3H2,1-2H3.
What are the key properties of 2-fluoro-2-methoxy-N-methylethanamine?
2-fluoro-2-methoxy-N-methylethanamine has a molecular weight of 107.13 g/mol, XLogP of 0.15, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-2-methoxy-N-methylethanamine is sourced from PubChem (CID 129280868), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).