(1-ethylpyrrolidin-3-yl) hypofluorite

C6H12FNO — CID 144717853

IUPAC(1-ethylpyrrolidin-3-yl) hypofluorite
SMILESCCN1CCC(OF)C1
InChIInChI=1S/C6H12FNO/c1-2-8-4-3-6(5-8)9-7/h6H,2-5H2,1H3
InChIKeyBJIKLXKLANPORB-UHFFFAOYSA-N
MW133.17 g/mol
LogP0.98
Rot. Bonds2

About (1-ethylpyrrolidin-3-yl) hypofluorite

(1-ethylpyrrolidin-3-yl) hypofluorite (PubChem CID 144717853) has the molecular formula C6H12FNO and a molecular weight of 133.17 g/mol. Its IUPAC name is (1-ethylpyrrolidin-3-yl) hypofluorite.

Molecular Properties

Compound Name(1-ethylpyrrolidin-3-yl) hypofluorite
PubChem CID144717853
Molecular FormulaC6H12FNO
Molecular Weight133.17 g/mol
Exact Mass133.09
IUPAC Name(1-ethylpyrrolidin-3-yl) hypofluorite
SMILESCCN1CCC(OF)C1
InChIInChI=1S/C6H12FNO/c1-2-8-4-3-6(5-8)9-7/h6H,2-5H2,1H3
InChIKeyBJIKLXKLANPORB-UHFFFAOYSA-N
XLogP0.98
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500133.17
LogP ≤ 50.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze (1-ethylpyrrolidin-3-yl) hypofluorite with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (1-ethylpyrrolidin-3-yl) hypofluorite?
The IUPAC name of (1-ethylpyrrolidin-3-yl) hypofluorite (CID 144717853) is (1-ethylpyrrolidin-3-yl) hypofluorite.
What is the SMILES notation for (1-ethylpyrrolidin-3-yl) hypofluorite?
The canonical SMILES for (1-ethylpyrrolidin-3-yl) hypofluorite is CCN1CCC(OF)C1.
What is the InChIKey of (1-ethylpyrrolidin-3-yl) hypofluorite?
The InChIKey is BJIKLXKLANPORB-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12FNO/c1-2-8-4-3-6(5-8)9-7/h6H,2-5H2,1H3.
What are the key properties of (1-ethylpyrrolidin-3-yl) hypofluorite?
(1-ethylpyrrolidin-3-yl) hypofluorite has a molecular weight of 133.17 g/mol, XLogP of 0.98, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1-ethylpyrrolidin-3-yl) hypofluorite is sourced from PubChem (CID 144717853), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).