1-(diethylamino)ethyl hypofluorite

C6H14FNO — CID 18952774

IUPAC1-(diethylamino)ethyl hypofluorite
SMILESCCN(CC)C(C)OF
InChIInChI=1S/C6H14FNO/c1-4-8(5-2)6(3)9-7/h6H,4-5H2,1-3H3
InChIKeyFWDGGSRSRKITFD-UHFFFAOYSA-N
MW135.18 g/mol
LogP1.58
Rot. Bonds4

About 1-(diethylamino)ethyl hypofluorite

1-(diethylamino)ethyl hypofluorite (PubChem CID 18952774) has the molecular formula C6H14FNO and a molecular weight of 135.18 g/mol. Its IUPAC name is 1-(diethylamino)ethyl hypofluorite.

Molecular Properties

Compound Name1-(diethylamino)ethyl hypofluorite
PubChem CID18952774
Molecular FormulaC6H14FNO
Molecular Weight135.18 g/mol
Exact Mass135.11
IUPAC Name1-(diethylamino)ethyl hypofluorite
SMILESCCN(CC)C(C)OF
InChIInChI=1S/C6H14FNO/c1-4-8(5-2)6(3)9-7/h6H,4-5H2,1-3H3
InChIKeyFWDGGSRSRKITFD-UHFFFAOYSA-N
XLogP1.58
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500135.18
LogP ≤ 51.58
H-Bond Donors ≤ 50
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-(diethylamino)ethyl hypofluorite?
The IUPAC name of 1-(diethylamino)ethyl hypofluorite (CID 18952774) is 1-(diethylamino)ethyl hypofluorite.
What is the SMILES notation for 1-(diethylamino)ethyl hypofluorite?
The canonical SMILES for 1-(diethylamino)ethyl hypofluorite is CCN(CC)C(C)OF.
What is the InChIKey of 1-(diethylamino)ethyl hypofluorite?
The InChIKey is FWDGGSRSRKITFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14FNO/c1-4-8(5-2)6(3)9-7/h6H,4-5H2,1-3H3.
What are the key properties of 1-(diethylamino)ethyl hypofluorite?
1-(diethylamino)ethyl hypofluorite has a molecular weight of 135.18 g/mol, XLogP of 1.58, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(diethylamino)ethyl hypofluorite is sourced from PubChem (CID 18952774), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).