1-aminopropyl hypofluorite

C3H8FNO — CID 57256793

IUPAC1-aminopropyl hypofluorite
SMILESCCC(N)OF
InChIInChI=1S/C3H8FNO/c1-2-3(5)6-4/h3H,2,5H2,1H3
InChIKeyMPBQPNHLQODREA-UHFFFAOYSA-N
MW93.10 g/mol
LogP0.58
Rot. Bonds2

About 1-aminopropyl hypofluorite

1-aminopropyl hypofluorite (PubChem CID 57256793) has the molecular formula C3H8FNO and a molecular weight of 93.10 g/mol. Its IUPAC name is 1-aminopropyl hypofluorite.

Molecular Properties

Compound Name1-aminopropyl hypofluorite
PubChem CID57256793
Molecular FormulaC3H8FNO
Molecular Weight93.10 g/mol
Exact Mass93.06
IUPAC Name1-aminopropyl hypofluorite
SMILESCCC(N)OF
InChIInChI=1S/C3H8FNO/c1-2-3(5)6-4/h3H,2,5H2,1H3
InChIKeyMPBQPNHLQODREA-UHFFFAOYSA-N
XLogP0.58
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50093.10
LogP ≤ 50.58
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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Frequently Asked Questions

What is the IUPAC name of 1-aminopropyl hypofluorite?
The IUPAC name of 1-aminopropyl hypofluorite (CID 57256793) is 1-aminopropyl hypofluorite.
What is the SMILES notation for 1-aminopropyl hypofluorite?
The canonical SMILES for 1-aminopropyl hypofluorite is CCC(N)OF.
What is the InChIKey of 1-aminopropyl hypofluorite?
The InChIKey is MPBQPNHLQODREA-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H8FNO/c1-2-3(5)6-4/h3H,2,5H2,1H3.
What are the key properties of 1-aminopropyl hypofluorite?
1-aminopropyl hypofluorite has a molecular weight of 93.10 g/mol, XLogP of 0.58, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-aminopropyl hypofluorite is sourced from PubChem (CID 57256793), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).