7,7-difluoro-4-methyl-4-azaspiro[2.6]nonane

C9H15F2N — CID 176557098

IUPAC7,7-difluoro-4-methyl-4-azaspiro[2.6]nonane
SMILESCN1CCC(F)(F)CCC12CC2
InChIInChI=1S/C9H15F2N/c1-12-7-6-9(10,11)5-4-8(12)2-3-8/h2-7H2,1H3
InChIKeyYZVQXKGPGXBDCN-UHFFFAOYSA-N
MW175.22 g/mol
LogP2.27
Rot. Bonds

About 7,7-difluoro-4-methyl-4-azaspiro[2.6]nonane

7,7-difluoro-4-methyl-4-azaspiro[2.6]nonane (PubChem CID 176557098) has the molecular formula C9H15F2N and a molecular weight of 175.22 g/mol. Its IUPAC name is 7,7-difluoro-4-methyl-4-azaspiro[2.6]nonane.

Molecular Properties

Compound Name7,7-difluoro-4-methyl-4-azaspiro[2.6]nonane
PubChem CID176557098
Molecular FormulaC9H15F2N
Molecular Weight175.22 g/mol
Exact Mass175.12
IUPAC Name7,7-difluoro-4-methyl-4-azaspiro[2.6]nonane
SMILESCN1CCC(F)(F)CCC12CC2
InChIInChI=1S/C9H15F2N/c1-12-7-6-9(10,11)5-4-8(12)2-3-8/h2-7H2,1H3
InChIKeyYZVQXKGPGXBDCN-UHFFFAOYSA-N
XLogP2.27
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.22
LogP ≤ 52.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N,2-dimethyl-N-(2,2,2-trifluoroethyl)nonan-2-amine
CID 156254810
5,6-Ditert-butyl-2,2-difluoro-5-azaspiro[2.6]nonane
CID 171756202
3,3-Difluoro-1,2-di(propan-2-yl)azepane
CID 171756249
2-(Difluoromethyl)-1,7-di(propan-2-yl)azepane
CID 172103523
4,4-Difluoro-1,2-di(propan-2-yl)azepane
CID 172103554
1-Tert-butyl-4-(difluoromethyl)-2-propan-2-ylazepane
CID 175613601
1,2-Ditert-butyl-6,6-difluoroazepane
CID 175613605
2-(Difluoromethyl)-1-methyl-7-propan-2-ylazepane
CID 175613814
(7,7,8-Trifluoro-4-methyl-4-azaspiro[2.6]nonan-8-yl)phosphane
CID 176557252
8,8-Difluoro-4-methyl-4-azaspiro[2.6]nonane
CID 176557268
4-Methyl-4-azaspiro[2.6]nonane
CID 11051731
4-Propan-2-yl-4-azaspiro[2.6]nonane
CID 130287392

Frequently Asked Questions

What is the IUPAC name of 7,7-difluoro-4-methyl-4-azaspiro[2.6]nonane?
The IUPAC name of 7,7-difluoro-4-methyl-4-azaspiro[2.6]nonane (CID 176557098) is 7,7-difluoro-4-methyl-4-azaspiro[2.6]nonane.
What is the SMILES notation for 7,7-difluoro-4-methyl-4-azaspiro[2.6]nonane?
The canonical SMILES for 7,7-difluoro-4-methyl-4-azaspiro[2.6]nonane is CN1CCC(F)(F)CCC12CC2.
What is the InChIKey of 7,7-difluoro-4-methyl-4-azaspiro[2.6]nonane?
The InChIKey is YZVQXKGPGXBDCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15F2N/c1-12-7-6-9(10,11)5-4-8(12)2-3-8/h2-7H2,1H3.
What are the key properties of 7,7-difluoro-4-methyl-4-azaspiro[2.6]nonane?
7,7-difluoro-4-methyl-4-azaspiro[2.6]nonane has a molecular weight of 175.22 g/mol, XLogP of 2.27, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 7,7-difluoro-4-methyl-4-azaspiro[2.6]nonane is sourced from PubChem (CID 176557098), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).