2-fluoro-3-methoxypropan-1-amine

C4H10FNO — CID 83853881

IUPAC2-fluoro-3-methoxypropan-1-amine
SMILESCOCC(F)CN
InChIInChI=1S/C4H10FNO/c1-7-3-4(5)2-6/h4H,2-3,6H2,1H3
InChIKeyBHXJIJFQIQVXKR-UHFFFAOYSA-N
MW107.13 g/mol
LogP-0.07
Rot. Bonds3

About 2-fluoro-3-methoxypropan-1-amine

2-fluoro-3-methoxypropan-1-amine (PubChem CID 83853881) has the molecular formula C4H10FNO and a molecular weight of 107.13 g/mol. Its IUPAC name is 2-fluoro-3-methoxypropan-1-amine.

Molecular Properties

Compound Name2-fluoro-3-methoxypropan-1-amine
PubChem CID83853881
Molecular FormulaC4H10FNO
Molecular Weight107.13 g/mol
Exact Mass107.07
IUPAC Name2-fluoro-3-methoxypropan-1-amine
SMILESCOCC(F)CN
InChIInChI=1S/C4H10FNO/c1-7-3-4(5)2-6/h4H,2-3,6H2,1H3
InChIKeyBHXJIJFQIQVXKR-UHFFFAOYSA-N
XLogP-0.07
TPSA35.25 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 ≤ 5-0.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-fluoro-3-methoxypropan-1-amine?
The IUPAC name of 2-fluoro-3-methoxypropan-1-amine (CID 83853881) is 2-fluoro-3-methoxypropan-1-amine.
What is the SMILES notation for 2-fluoro-3-methoxypropan-1-amine?
The canonical SMILES for 2-fluoro-3-methoxypropan-1-amine is COCC(F)CN.
What is the InChIKey of 2-fluoro-3-methoxypropan-1-amine?
The InChIKey is BHXJIJFQIQVXKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10FNO/c1-7-3-4(5)2-6/h4H,2-3,6H2,1H3.
What are the key properties of 2-fluoro-3-methoxypropan-1-amine?
2-fluoro-3-methoxypropan-1-amine has a molecular weight of 107.13 g/mol, XLogP of -0.07, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-3-methoxypropan-1-amine is sourced from PubChem (CID 83853881), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).