2-(difluoromethylidene)-7-methyl-7-azaspiro[3.5]nonane

C10H15F2N — CID 167272208

IUPAC2-(difluoromethylidene)-7-methyl-7-azaspiro[3.5]nonane
SMILESCN1CCC2(CC1)CC(=C(F)F)C2
InChIInChI=1S/C10H15F2N/c1-13-4-2-10(3-5-13)6-8(7-10)9(11)12/h2-7H2,1H3
InChIKeyLUYJBUIFESXXBT-UHFFFAOYSA-N
MW187.23 g/mol
LogP2.64
Rot. Bonds

About 2-(difluoromethylidene)-7-methyl-7-azaspiro[3.5]nonane

2-(difluoromethylidene)-7-methyl-7-azaspiro[3.5]nonane (PubChem CID 167272208) has the molecular formula C10H15F2N and a molecular weight of 187.23 g/mol. Its IUPAC name is 2-(difluoromethylidene)-7-methyl-7-azaspiro[3.5]nonane.

Molecular Properties

Compound Name2-(difluoromethylidene)-7-methyl-7-azaspiro[3.5]nonane
PubChem CID167272208
Molecular FormulaC10H15F2N
Molecular Weight187.23 g/mol
Exact Mass187.12
IUPAC Name2-(difluoromethylidene)-7-methyl-7-azaspiro[3.5]nonane
SMILESCN1CCC2(CC1)CC(=C(F)F)C2
InChIInChI=1S/C10H15F2N/c1-13-4-2-10(3-5-13)6-8(7-10)9(11)12/h2-7H2,1H3
InChIKeyLUYJBUIFESXXBT-UHFFFAOYSA-N
XLogP2.64
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.23
LogP ≤ 52.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-(difluoromethylidene)-7-methyl-7-azaspiro[3.5]nonane?
The IUPAC name of 2-(difluoromethylidene)-7-methyl-7-azaspiro[3.5]nonane (CID 167272208) is 2-(difluoromethylidene)-7-methyl-7-azaspiro[3.5]nonane.
What is the SMILES notation for 2-(difluoromethylidene)-7-methyl-7-azaspiro[3.5]nonane?
The canonical SMILES for 2-(difluoromethylidene)-7-methyl-7-azaspiro[3.5]nonane is CN1CCC2(CC1)CC(=C(F)F)C2.
What is the InChIKey of 2-(difluoromethylidene)-7-methyl-7-azaspiro[3.5]nonane?
The InChIKey is LUYJBUIFESXXBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15F2N/c1-13-4-2-10(3-5-13)6-8(7-10)9(11)12/h2-7H2,1H3.
What are the key properties of 2-(difluoromethylidene)-7-methyl-7-azaspiro[3.5]nonane?
2-(difluoromethylidene)-7-methyl-7-azaspiro[3.5]nonane has a molecular weight of 187.23 g/mol, XLogP of 2.64, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(difluoromethylidene)-7-methyl-7-azaspiro[3.5]nonane is sourced from PubChem (CID 167272208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).