6-(difluoromethyl)-6-methoxy-2-methyl-2-azaspiro[3.3]heptane

C9H15F2NO — CID 118974352

IUPAC6-(difluoromethyl)-6-methoxy-2-methyl-2-azaspiro[3.3]heptane
SMILESCOC1(C(F)F)CC2(CN(C)C2)C1
InChIInChI=1S/C9H15F2NO/c1-12-5-8(6-12)3-9(4-8,13-2)7(10)11/h7H,3-6H2,1-2H3
InChIKeyYQJIAJLHQMABHW-UHFFFAOYSA-N
MW191.22 g/mol
LogP1.36
Rot. Bonds2

About 6-(difluoromethyl)-6-methoxy-2-methyl-2-azaspiro[3.3]heptane

6-(difluoromethyl)-6-methoxy-2-methyl-2-azaspiro[3.3]heptane (PubChem CID 118974352) has the molecular formula C9H15F2NO and a molecular weight of 191.22 g/mol. Its IUPAC name is 6-(difluoromethyl)-6-methoxy-2-methyl-2-azaspiro[3.3]heptane.

Molecular Properties

Compound Name6-(difluoromethyl)-6-methoxy-2-methyl-2-azaspiro[3.3]heptane
PubChem CID118974352
Molecular FormulaC9H15F2NO
Molecular Weight191.22 g/mol
Exact Mass191.11
IUPAC Name6-(difluoromethyl)-6-methoxy-2-methyl-2-azaspiro[3.3]heptane
SMILESCOC1(C(F)F)CC2(CN(C)C2)C1
InChIInChI=1S/C9H15F2NO/c1-12-5-8(6-12)3-9(4-8,13-2)7(10)11/h7H,3-6H2,1-2H3
InChIKeyYQJIAJLHQMABHW-UHFFFAOYSA-N
XLogP1.36
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.22
LogP ≤ 51.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 6-(difluoromethyl)-6-methoxy-2-methyl-2-azaspiro[3.3]heptane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-methyl-6-propan-2-yl-2-azaspiro[3.3]heptan-6-ol
CID 134410201
3,3-difluoro-1-methylazetidine;ethane;methane
CID 153377550
3-methoxy-1-methyl-3-propan-2-ylpyrrolidine
CID 163257812
3-fluoro-1,3-dimethylazetidine
CID 89296536
ethane;2-methyl-2,7-diazaspiro[3.5]nonane
CID 143448801
2,2-difluoro-5-methyl-5-azaspiro[2.3]hexane
CID 129180153
2,7-dimethyl-2,7-diazaspiro[3.4]octane;ethane
CID 143122018
ethane;2-methyl-2-azaspiro[3.6]decane
CID 90761663
ethane;methane;2-methyl-6-propan-2-yl-2,6-diazaspiro[3.4]octane
CID 162125868
6-fluoro-6-methyl-2-propan-2-yl-2-azaspiro[3.3]heptane
CID 156813146
3-(difluoromethyl)-3-methoxypiperidine
CID 167723798
2-methyl-2-azaspiro[3.3]heptane
CID 22975634

Frequently Asked Questions

What is the IUPAC name of 6-(difluoromethyl)-6-methoxy-2-methyl-2-azaspiro[3.3]heptane?
The IUPAC name of 6-(difluoromethyl)-6-methoxy-2-methyl-2-azaspiro[3.3]heptane (CID 118974352) is 6-(difluoromethyl)-6-methoxy-2-methyl-2-azaspiro[3.3]heptane.
What is the SMILES notation for 6-(difluoromethyl)-6-methoxy-2-methyl-2-azaspiro[3.3]heptane?
The canonical SMILES for 6-(difluoromethyl)-6-methoxy-2-methyl-2-azaspiro[3.3]heptane is COC1(C(F)F)CC2(CN(C)C2)C1.
What is the InChIKey of 6-(difluoromethyl)-6-methoxy-2-methyl-2-azaspiro[3.3]heptane?
The InChIKey is YQJIAJLHQMABHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15F2NO/c1-12-5-8(6-12)3-9(4-8,13-2)7(10)11/h7H,3-6H2,1-2H3.
What are the key properties of 6-(difluoromethyl)-6-methoxy-2-methyl-2-azaspiro[3.3]heptane?
6-(difluoromethyl)-6-methoxy-2-methyl-2-azaspiro[3.3]heptane has a molecular weight of 191.22 g/mol, XLogP of 1.36, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(difluoromethyl)-6-methoxy-2-methyl-2-azaspiro[3.3]heptane is sourced from PubChem (CID 118974352), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).