7-(difluoromethoxy)-4-azaspiro[2.5]octane

C8H13F2NO — CID 150394627

IUPAC7-(difluoromethoxy)-4-azaspiro[2.5]octane
SMILESFC(F)OC1CCNC2(CC2)C1
InChIInChI=1S/C8H13F2NO/c9-7(10)12-6-1-4-11-8(5-6)2-3-8/h6-7,11H,1-5H2
InChIKeyHCLGFVHCVTXPTK-UHFFFAOYSA-N
MW177.19 g/mol
LogP1.51
Rot. Bonds2

About 7-(difluoromethoxy)-4-azaspiro[2.5]octane

7-(difluoromethoxy)-4-azaspiro[2.5]octane (PubChem CID 150394627) has the molecular formula C8H13F2NO and a molecular weight of 177.19 g/mol. Its IUPAC name is 7-(difluoromethoxy)-4-azaspiro[2.5]octane.

Molecular Properties

Compound Name7-(difluoromethoxy)-4-azaspiro[2.5]octane
PubChem CID150394627
Molecular FormulaC8H13F2NO
Molecular Weight177.19 g/mol
Exact Mass177.10
IUPAC Name7-(difluoromethoxy)-4-azaspiro[2.5]octane
SMILESFC(F)OC1CCNC2(CC2)C1
InChIInChI=1S/C8H13F2NO/c9-7(10)12-6-1-4-11-8(5-6)2-3-8/h6-7,11H,1-5H2
InChIKeyHCLGFVHCVTXPTK-UHFFFAOYSA-N
XLogP1.51
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.19
LogP ≤ 51.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 7-(difluoromethoxy)-4-azaspiro[2.5]octane?
The IUPAC name of 7-(difluoromethoxy)-4-azaspiro[2.5]octane (CID 150394627) is 7-(difluoromethoxy)-4-azaspiro[2.5]octane.
What is the SMILES notation for 7-(difluoromethoxy)-4-azaspiro[2.5]octane?
The canonical SMILES for 7-(difluoromethoxy)-4-azaspiro[2.5]octane is FC(F)OC1CCNC2(CC2)C1.
What is the InChIKey of 7-(difluoromethoxy)-4-azaspiro[2.5]octane?
The InChIKey is HCLGFVHCVTXPTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13F2NO/c9-7(10)12-6-1-4-11-8(5-6)2-3-8/h6-7,11H,1-5H2.
What are the key properties of 7-(difluoromethoxy)-4-azaspiro[2.5]octane?
7-(difluoromethoxy)-4-azaspiro[2.5]octane has a molecular weight of 177.19 g/mol, XLogP of 1.51, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(difluoromethoxy)-4-azaspiro[2.5]octane is sourced from PubChem (CID 150394627), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).