3-(2-oxa-6-azaspiro[3.3]heptan-6-yl)propyl hypofluorite

C8H14FNO2 — CID 154661222

IUPAC3-(2-oxa-6-azaspiro[3.3]heptan-6-yl)propyl hypofluorite
SMILESFOCCCN1CC2(COC2)C1
InChIInChI=1S/C8H14FNO2/c9-12-3-1-2-10-4-8(5-10)6-11-7-8/h1-7H2
InChIKeyGVHNOZKIOKAYHJ-UHFFFAOYSA-N
MW175.20 g/mol
LogP0.61
Rot. Bonds4

About 3-(2-oxa-6-azaspiro[3.3]heptan-6-yl)propyl hypofluorite

3-(2-oxa-6-azaspiro[3.3]heptan-6-yl)propyl hypofluorite (PubChem CID 154661222) has the molecular formula C8H14FNO2 and a molecular weight of 175.20 g/mol. Its IUPAC name is 3-(2-oxa-6-azaspiro[3.3]heptan-6-yl)propyl hypofluorite.

Molecular Properties

Compound Name3-(2-oxa-6-azaspiro[3.3]heptan-6-yl)propyl hypofluorite
PubChem CID154661222
Molecular FormulaC8H14FNO2
Molecular Weight175.20 g/mol
Exact Mass175.10
IUPAC Name3-(2-oxa-6-azaspiro[3.3]heptan-6-yl)propyl hypofluorite
SMILESFOCCCN1CC2(COC2)C1
InChIInChI=1S/C8H14FNO2/c9-12-3-1-2-10-4-8(5-10)6-11-7-8/h1-7H2
InChIKeyGVHNOZKIOKAYHJ-UHFFFAOYSA-N
XLogP0.61
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.20
LogP ≤ 50.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

3-(2-Oxa-6-azaspiro(3.3)heptan-6-yl)propan-1-ol
CID 71471123
6-(Prop-2-yn-1-yl)-2-oxa-6-azaspiro[3.3]heptane
CID 168440635
2-Oxetanamine, N,N-bis(3,3-dimethyl-2-oxetanyl)-3,3-dimethyl-
CID 594022
6-Methyl-2-oxa-6-azaspiro[3.3]heptane
CID 59154926
6-Fluoro-2-oxa-6-azaspiro[3.3]heptane
CID 145549849
6-Butyl-2-oxa-6-azaspiro[3.3]heptane
CID 13778350
6-(2,2-Dimethylpropyl)-2-oxa-6-azaspiro[3.3]heptane
CID 58266684
6-Propan-2-yl-2-oxa-6-azaspiro[3.3]heptane
CID 58464450
6-Ethyl-2-oxa-6-azaspiro[3.3]heptane
CID 68029725
6-Propyl-2-oxa-6-azaspiro[3.3]heptane
CID 68346908
6-(2-Methoxyethyl)-2-oxa-6-azaspiro[3.3]heptane
CID 89851152
6-(2-Methylpropyl)-2-oxa-6-azaspiro[3.3]heptane
CID 121401085

Frequently Asked Questions

What is the IUPAC name of 3-(2-oxa-6-azaspiro[3.3]heptan-6-yl)propyl hypofluorite?
The IUPAC name of 3-(2-oxa-6-azaspiro[3.3]heptan-6-yl)propyl hypofluorite (CID 154661222) is 3-(2-oxa-6-azaspiro[3.3]heptan-6-yl)propyl hypofluorite.
What is the SMILES notation for 3-(2-oxa-6-azaspiro[3.3]heptan-6-yl)propyl hypofluorite?
The canonical SMILES for 3-(2-oxa-6-azaspiro[3.3]heptan-6-yl)propyl hypofluorite is FOCCCN1CC2(COC2)C1.
What is the InChIKey of 3-(2-oxa-6-azaspiro[3.3]heptan-6-yl)propyl hypofluorite?
The InChIKey is GVHNOZKIOKAYHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14FNO2/c9-12-3-1-2-10-4-8(5-10)6-11-7-8/h1-7H2.
What are the key properties of 3-(2-oxa-6-azaspiro[3.3]heptan-6-yl)propyl hypofluorite?
3-(2-oxa-6-azaspiro[3.3]heptan-6-yl)propyl hypofluorite has a molecular weight of 175.20 g/mol, XLogP of 0.61, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-oxa-6-azaspiro[3.3]heptan-6-yl)propyl hypofluorite is sourced from PubChem (CID 154661222), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).