2,2-difluoro-7-methyl-4-oxa-7-azaspiro[2.5]octane

C7H11F2NO — CID 176682809

IUPAC2,2-difluoro-7-methyl-4-oxa-7-azaspiro[2.5]octane
SMILESCN1CCOC2(C1)CC2(F)F
InChIInChI=1S/C7H11F2NO/c1-10-2-3-11-6(5-10)4-7(6,8)9/h2-5H2,1H3
InChIKeyHSXOEUKIHUTTBT-UHFFFAOYSA-N
MW163.17 g/mol
LogP0.73
Rot. Bonds

About 2,2-difluoro-7-methyl-4-oxa-7-azaspiro[2.5]octane

2,2-difluoro-7-methyl-4-oxa-7-azaspiro[2.5]octane (PubChem CID 176682809) has the molecular formula C7H11F2NO and a molecular weight of 163.17 g/mol. Its IUPAC name is 2,2-difluoro-7-methyl-4-oxa-7-azaspiro[2.5]octane.

Molecular Properties

Compound Name2,2-difluoro-7-methyl-4-oxa-7-azaspiro[2.5]octane
PubChem CID176682809
Molecular FormulaC7H11F2NO
Molecular Weight163.17 g/mol
Exact Mass163.08
IUPAC Name2,2-difluoro-7-methyl-4-oxa-7-azaspiro[2.5]octane
SMILESCN1CCOC2(C1)CC2(F)F
InChIInChI=1S/C7H11F2NO/c1-10-2-3-11-6(5-10)4-7(6,8)9/h2-5H2,1H3
InChIKeyHSXOEUKIHUTTBT-UHFFFAOYSA-N
XLogP0.73
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.17
LogP ≤ 50.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 2,2-difluoro-7-methyl-4-oxa-7-azaspiro[2.5]octane with MolForge

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

Launch Full Analysis

Related Compounds

ethane;9-ethyl-4-methyl-1-oxa-4,9-diazaspiro[5.5]undecane
CID 171845223
9-fluoro-4-methyl-1-oxa-4,9-diazaspiro[5.5]undecane
CID 166686001
2-ethyl-4-methyl-2-propylmorpholine
CID 166075483
4-methyl-1-oxa-4-azaspiro[5.5]undecane
CID 23544679
2-butyl-2-chloro-4-methylmorpholine
CID 141318115
2,2-difluoro-3-methyl-1,3-oxazolidine
CID 67205796
8-methyl-5-oxa-2λ4-thia-8-azaspiro[3.5]nonane 2-oxide
CID 155010335
(4,4-difluoropiperidin-1-yl)-(2,4-dimethylmorpholin-2-yl)methanone
CID 73439501
2,2-difluoro-5-methyl-5-azaspiro[2.3]hexane
CID 129180153
(2-hydroxy-4-methylmorpholin-2-yl) acetate
CID 172553442
3,3-difluoro-1-methylpyrrolidine;propane
CID 143065590
3,3-difluoro-1-methylpiperidine-4,4-diol
CID 169410012

Frequently Asked Questions

What is the IUPAC name of 2,2-difluoro-7-methyl-4-oxa-7-azaspiro[2.5]octane?
The IUPAC name of 2,2-difluoro-7-methyl-4-oxa-7-azaspiro[2.5]octane (CID 176682809) is 2,2-difluoro-7-methyl-4-oxa-7-azaspiro[2.5]octane.
What is the SMILES notation for 2,2-difluoro-7-methyl-4-oxa-7-azaspiro[2.5]octane?
The canonical SMILES for 2,2-difluoro-7-methyl-4-oxa-7-azaspiro[2.5]octane is CN1CCOC2(C1)CC2(F)F.
What is the InChIKey of 2,2-difluoro-7-methyl-4-oxa-7-azaspiro[2.5]octane?
The InChIKey is HSXOEUKIHUTTBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11F2NO/c1-10-2-3-11-6(5-10)4-7(6,8)9/h2-5H2,1H3.
What are the key properties of 2,2-difluoro-7-methyl-4-oxa-7-azaspiro[2.5]octane?
2,2-difluoro-7-methyl-4-oxa-7-azaspiro[2.5]octane has a molecular weight of 163.17 g/mol, XLogP of 0.73, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-difluoro-7-methyl-4-oxa-7-azaspiro[2.5]octane is sourced from PubChem (CID 176682809), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).