7-(difluoromethylidene)-4-azaspiro[2.4]heptane

C7H9F2N — CID 170905023

IUPAC7-(difluoromethylidene)-4-azaspiro[2.4]heptane
SMILESFC(F)=C1CCNC12CC2
InChIInChI=1S/C7H9F2N/c8-6(9)5-1-4-10-7(5)2-3-7/h10H,1-4H2
InChIKeyDOESQYOJIOAMIN-UHFFFAOYSA-N
MW145.15 g/mol
LogP1.66
Rot. Bonds

About 7-(difluoromethylidene)-4-azaspiro[2.4]heptane

7-(difluoromethylidene)-4-azaspiro[2.4]heptane (PubChem CID 170905023) has the molecular formula C7H9F2N and a molecular weight of 145.15 g/mol. Its IUPAC name is 7-(difluoromethylidene)-4-azaspiro[2.4]heptane.

Molecular Properties

Compound Name7-(difluoromethylidene)-4-azaspiro[2.4]heptane
PubChem CID170905023
Molecular FormulaC7H9F2N
Molecular Weight145.15 g/mol
Exact Mass145.07
IUPAC Name7-(difluoromethylidene)-4-azaspiro[2.4]heptane
SMILESFC(F)=C1CCNC12CC2
InChIInChI=1S/C7H9F2N/c8-6(9)5-1-4-10-7(5)2-3-7/h10H,1-4H2
InChIKeyDOESQYOJIOAMIN-UHFFFAOYSA-N
XLogP1.66
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.15
LogP ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

7,7-Difluoro-4-azaspiro[2.4]heptane
CID 83856341
6,6-Difluoro-4-azaspiro[2.4]heptane
CID 142576662
7,7-Difluoro-1,2-dimethyl-4-azaspiro[2.4]hept-1-ene
CID 146640283
7,7-Difluoro-4-azaspiro[2.4]hept-1-ene
CID 146640285
3,3-Difluoro-2-methyl-2-prop-1-en-2-ylpyrrolidine
CID 147394218
1,1-Difluoro-4-azaspiro[2.4]heptane
CID 157075610
2-Methyl-2-(3,3,3-trifluoroprop-1-en-2-yl)pyrrolidine
CID 130564824
2-Ethyl-2-(3,3,3-trifluoroprop-1-en-2-yl)pyrrolidine
CID 130564825
4-(Difluoromethylidene)-2,2-diethylpyrrolidine
CID 169181315
7-(Difluoromethylidene)-5-azaspiro[3.4]octane
CID 177217127
6-Methylidene-4-azaspiro[2.4]heptane
CID 118989888
7-Methylidene-4-azaspiro[2.4]heptane
CID 144353143

Frequently Asked Questions

What is the IUPAC name of 7-(difluoromethylidene)-4-azaspiro[2.4]heptane?
The IUPAC name of 7-(difluoromethylidene)-4-azaspiro[2.4]heptane (CID 170905023) is 7-(difluoromethylidene)-4-azaspiro[2.4]heptane.
What is the SMILES notation for 7-(difluoromethylidene)-4-azaspiro[2.4]heptane?
The canonical SMILES for 7-(difluoromethylidene)-4-azaspiro[2.4]heptane is FC(F)=C1CCNC12CC2.
What is the InChIKey of 7-(difluoromethylidene)-4-azaspiro[2.4]heptane?
The InChIKey is DOESQYOJIOAMIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9F2N/c8-6(9)5-1-4-10-7(5)2-3-7/h10H,1-4H2.
What are the key properties of 7-(difluoromethylidene)-4-azaspiro[2.4]heptane?
7-(difluoromethylidene)-4-azaspiro[2.4]heptane has a molecular weight of 145.15 g/mol, XLogP of 1.66, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(difluoromethylidene)-4-azaspiro[2.4]heptane is sourced from PubChem (CID 170905023), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).