2,2-difluoro-6-methyl-5-azaspiro[2.6]nonane

C9H15F2N — CID 170772056

IUPAC2,2-difluoro-6-methyl-5-azaspiro[2.6]nonane
SMILESCC1CCCC2(CN1)CC2(F)F
InChIInChI=1S/C9H15F2N/c1-7-3-2-4-8(6-12-7)5-9(8,10)11/h7,12H,2-6H2,1H3
InChIKeyVXDOWSNLMRDZSL-UHFFFAOYSA-N
MW175.22 g/mol
LogP2.17
Rot. Bonds

About 2,2-difluoro-6-methyl-5-azaspiro[2.6]nonane

2,2-difluoro-6-methyl-5-azaspiro[2.6]nonane (PubChem CID 170772056) has the molecular formula C9H15F2N and a molecular weight of 175.22 g/mol. Its IUPAC name is 2,2-difluoro-6-methyl-5-azaspiro[2.6]nonane.

Molecular Properties

Compound Name2,2-difluoro-6-methyl-5-azaspiro[2.6]nonane
PubChem CID170772056
Molecular FormulaC9H15F2N
Molecular Weight175.22 g/mol
Exact Mass175.12
IUPAC Name2,2-difluoro-6-methyl-5-azaspiro[2.6]nonane
SMILESCC1CCCC2(CN1)CC2(F)F
InChIInChI=1S/C9H15F2N/c1-7-3-2-4-8(6-12-7)5-9(8,10)11/h7,12H,2-6H2,1H3
InChIKeyVXDOWSNLMRDZSL-UHFFFAOYSA-N
XLogP2.17
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.22
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

8-methyl-7-azaspiro[4.5]decane
CID 118001597
4,4,5,5-tetrafluoro-2-methylpiperidine
CID 157309012
2-methylpyrrolidine
CID 13003
2-methylpyrrolidine
CID 142041388
6-methyl-5-azaspiro[2.5]octane;hydrochloride
CID 178127379
(2,2-difluorospiro[2.5]octan-7-yl)methanol
CID 155893433
2-methylpiperidine
CID 7974
methane;2-methylpiperidine
CID 159247179
(2S)-2-methylazocane
CID 137404038
(2R)-2-methylazonane
CID 89251055
(2S)-2-methylpiperidine;(2S)-2-methylpyrrolidine
CID 164977059
7-fluoro-2-methylazocane
CID 178025947

Frequently Asked Questions

What is the IUPAC name of 2,2-difluoro-6-methyl-5-azaspiro[2.6]nonane?
The IUPAC name of 2,2-difluoro-6-methyl-5-azaspiro[2.6]nonane (CID 170772056) is 2,2-difluoro-6-methyl-5-azaspiro[2.6]nonane.
What is the SMILES notation for 2,2-difluoro-6-methyl-5-azaspiro[2.6]nonane?
The canonical SMILES for 2,2-difluoro-6-methyl-5-azaspiro[2.6]nonane is CC1CCCC2(CN1)CC2(F)F.
What is the InChIKey of 2,2-difluoro-6-methyl-5-azaspiro[2.6]nonane?
The InChIKey is VXDOWSNLMRDZSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15F2N/c1-7-3-2-4-8(6-12-7)5-9(8,10)11/h7,12H,2-6H2,1H3.
What are the key properties of 2,2-difluoro-6-methyl-5-azaspiro[2.6]nonane?
2,2-difluoro-6-methyl-5-azaspiro[2.6]nonane has a molecular weight of 175.22 g/mol, XLogP of 2.17, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-difluoro-6-methyl-5-azaspiro[2.6]nonane is sourced from PubChem (CID 170772056), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).