(2-amino-3-methylbutyl) hypofluorite

C5H12FNO — CID 143535267

IUPAC(2-amino-3-methylbutyl) hypofluorite
SMILESCC(C)C(N)COF
InChIInChI=1S/C5H12FNO/c1-4(2)5(7)3-8-6/h4-5H,3,7H2,1-2H3
InChIKeyDFXQVOMHLCBRNF-UHFFFAOYSA-N
MW121.15 g/mol
LogP0.87
Rot. Bonds3

About (2-amino-3-methylbutyl) hypofluorite

(2-amino-3-methylbutyl) hypofluorite (PubChem CID 143535267) has the molecular formula C5H12FNO and a molecular weight of 121.15 g/mol. Its IUPAC name is (2-amino-3-methylbutyl) hypofluorite.

Molecular Properties

Compound Name(2-amino-3-methylbutyl) hypofluorite
PubChem CID143535267
Molecular FormulaC5H12FNO
Molecular Weight121.15 g/mol
Exact Mass121.09
IUPAC Name(2-amino-3-methylbutyl) hypofluorite
SMILESCC(C)C(N)COF
InChIInChI=1S/C5H12FNO/c1-4(2)5(7)3-8-6/h4-5H,3,7H2,1-2H3
InChIKeyDFXQVOMHLCBRNF-UHFFFAOYSA-N
XLogP0.87
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500121.15
LogP ≤ 50.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (2-amino-3-methylbutyl) 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 (2-amino-3-methylbutyl) hypofluorite?
The IUPAC name of (2-amino-3-methylbutyl) hypofluorite (CID 143535267) is (2-amino-3-methylbutyl) hypofluorite.
What is the SMILES notation for (2-amino-3-methylbutyl) hypofluorite?
The canonical SMILES for (2-amino-3-methylbutyl) hypofluorite is CC(C)C(N)COF.
What is the InChIKey of (2-amino-3-methylbutyl) hypofluorite?
The InChIKey is DFXQVOMHLCBRNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H12FNO/c1-4(2)5(7)3-8-6/h4-5H,3,7H2,1-2H3.
What are the key properties of (2-amino-3-methylbutyl) hypofluorite?
(2-amino-3-methylbutyl) hypofluorite has a molecular weight of 121.15 g/mol, XLogP of 0.87, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-amino-3-methylbutyl) hypofluorite is sourced from PubChem (CID 143535267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).