7,7-difluoro-3-methyl-2-methylidene-1-azaspiro[3.5]nonane

C10H15F2N — CID 155274734

IUPAC7,7-difluoro-3-methyl-2-methylidene-1-azaspiro[3.5]nonane
SMILESC=C1NC2(CCC(F)(F)CC2)C1C
InChIInChI=1S/C10H15F2N/c1-7-8(2)13-9(7)3-5-10(11,12)6-4-9/h7,13H,2-6H2,1H3
InChIKeyNDDLVKOIXBUFHW-UHFFFAOYSA-N
MW187.23 g/mol
LogP2.69
Rot. Bonds

About 7,7-difluoro-3-methyl-2-methylidene-1-azaspiro[3.5]nonane

7,7-difluoro-3-methyl-2-methylidene-1-azaspiro[3.5]nonane (PubChem CID 155274734) has the molecular formula C10H15F2N and a molecular weight of 187.23 g/mol. Its IUPAC name is 7,7-difluoro-3-methyl-2-methylidene-1-azaspiro[3.5]nonane.

Molecular Properties

Compound Name7,7-difluoro-3-methyl-2-methylidene-1-azaspiro[3.5]nonane
PubChem CID155274734
Molecular FormulaC10H15F2N
Molecular Weight187.23 g/mol
Exact Mass187.12
IUPAC Name7,7-difluoro-3-methyl-2-methylidene-1-azaspiro[3.5]nonane
SMILESC=C1NC2(CCC(F)(F)CC2)C1C
InChIInChI=1S/C10H15F2N/c1-7-8(2)13-9(7)3-5-10(11,12)6-4-9/h7,13H,2-6H2,1H3
InChIKeyNDDLVKOIXBUFHW-UHFFFAOYSA-N
XLogP2.69
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.23
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 7,7-difluoro-3-methyl-2-methylidene-1-azaspiro[3.5]nonane?
The IUPAC name of 7,7-difluoro-3-methyl-2-methylidene-1-azaspiro[3.5]nonane (CID 155274734) is 7,7-difluoro-3-methyl-2-methylidene-1-azaspiro[3.5]nonane.
What is the SMILES notation for 7,7-difluoro-3-methyl-2-methylidene-1-azaspiro[3.5]nonane?
The canonical SMILES for 7,7-difluoro-3-methyl-2-methylidene-1-azaspiro[3.5]nonane is C=C1NC2(CCC(F)(F)CC2)C1C.
What is the InChIKey of 7,7-difluoro-3-methyl-2-methylidene-1-azaspiro[3.5]nonane?
The InChIKey is NDDLVKOIXBUFHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15F2N/c1-7-8(2)13-9(7)3-5-10(11,12)6-4-9/h7,13H,2-6H2,1H3.
What are the key properties of 7,7-difluoro-3-methyl-2-methylidene-1-azaspiro[3.5]nonane?
7,7-difluoro-3-methyl-2-methylidene-1-azaspiro[3.5]nonane has a molecular weight of 187.23 g/mol, XLogP of 2.69, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 7,7-difluoro-3-methyl-2-methylidene-1-azaspiro[3.5]nonane is sourced from PubChem (CID 155274734), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).