4-(2,2-difluoroethyl)-3,3-diethyl-1,4-diazaspiro[5.5]undecane

C15H28F2N2 — CID 64876676

IUPAC4-(2,2-difluoroethyl)-3,3-diethyl-1,4-diazaspiro[5.5]undecane
SMILESCCC1(CC)CNC2(CCCCC2)CN1CC(F)F
InChIInChI=1S/C15H28F2N2/c1-3-15(4-2)11-18-14(8-6-5-7-9-14)12-19(15)10-13(16)17/h13,18H,3-12H2,1-2H3
InChIKeyBQJGOOXXQIALHU-UHFFFAOYSA-N
MW274.40 g/mol
LogP3.42
Rot. Bonds4

About 4-(2,2-difluoroethyl)-3,3-diethyl-1,4-diazaspiro[5.5]undecane

4-(2,2-difluoroethyl)-3,3-diethyl-1,4-diazaspiro[5.5]undecane (PubChem CID 64876676) has the molecular formula C15H28F2N2 and a molecular weight of 274.40 g/mol. Its IUPAC name is 4-(2,2-difluoroethyl)-3,3-diethyl-1,4-diazaspiro[5.5]undecane.

Molecular Properties

Compound Name4-(2,2-difluoroethyl)-3,3-diethyl-1,4-diazaspiro[5.5]undecane
PubChem CID64876676
Molecular FormulaC15H28F2N2
Molecular Weight274.40 g/mol
Exact Mass274.22
IUPAC Name4-(2,2-difluoroethyl)-3,3-diethyl-1,4-diazaspiro[5.5]undecane
SMILESCCC1(CC)CNC2(CCCCC2)CN1CC(F)F
InChIInChI=1S/C15H28F2N2/c1-3-15(4-2)11-18-14(8-6-5-7-9-14)12-19(15)10-13(16)17/h13,18H,3-12H2,1-2H3
InChIKeyBQJGOOXXQIALHU-UHFFFAOYSA-N
XLogP3.42
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.40
LogP ≤ 53.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 4-(2,2-difluoroethyl)-3,3-diethyl-1,4-diazaspiro[5.5]undecane 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

8,8-diethyl-9-(2-methylbutyl)-6,9-diazaspiro[4.5]decane
CID 64878169
3,3-diethyl-4-pentyl-1,4-diazaspiro[5.5]undecane
CID 64877638
3,3-diethyl-4-(2-methoxyethyl)-1,4-diazaspiro[5.5]undecane
CID 64878022
3,3-diethyl-4-(2-methylsulfonylethyl)-1,4-diazaspiro[5.5]undecane
CID 64878214
8,8-diethyl-9-(oxolan-2-ylmethyl)-6,9-diazaspiro[4.5]decane
CID 64877784
8,8-diethyl-9-(pyridin-2-ylmethyl)-6,9-diazaspiro[4.5]decane
CID 64877786
8-ethyl-9-(2-methoxypropyl)-8-methyl-6,9-diazaspiro[4.5]decane
CID 113383044
8-ethyl-9-(2-fluoroethyl)-8-methyl-6,9-diazaspiro[4.5]decane
CID 80697005
3,3-dimethyl-4-(3-methylbutyl)-1,4-diazaspiro[5.5]undecane
CID 64876284
16-(3-methylbutyl)-8,16-diazadispiro[5.2.59.26]hexadecane
CID 64877449
14-(2-methylbutyl)-7,14-diazadispiro[4.2.48.25]tetradecane
CID 64878172
1-azaspiro[2.6]nonane;propane
CID 171101466

Frequently Asked Questions

What is the IUPAC name of 4-(2,2-difluoroethyl)-3,3-diethyl-1,4-diazaspiro[5.5]undecane?
The IUPAC name of 4-(2,2-difluoroethyl)-3,3-diethyl-1,4-diazaspiro[5.5]undecane (CID 64876676) is 4-(2,2-difluoroethyl)-3,3-diethyl-1,4-diazaspiro[5.5]undecane.
What is the SMILES notation for 4-(2,2-difluoroethyl)-3,3-diethyl-1,4-diazaspiro[5.5]undecane?
The canonical SMILES for 4-(2,2-difluoroethyl)-3,3-diethyl-1,4-diazaspiro[5.5]undecane is CCC1(CC)CNC2(CCCCC2)CN1CC(F)F.
What is the InChIKey of 4-(2,2-difluoroethyl)-3,3-diethyl-1,4-diazaspiro[5.5]undecane?
The InChIKey is BQJGOOXXQIALHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28F2N2/c1-3-15(4-2)11-18-14(8-6-5-7-9-14)12-19(15)10-13(16)17/h13,18H,3-12H2,1-2H3.
What are the key properties of 4-(2,2-difluoroethyl)-3,3-diethyl-1,4-diazaspiro[5.5]undecane?
4-(2,2-difluoroethyl)-3,3-diethyl-1,4-diazaspiro[5.5]undecane has a molecular weight of 274.40 g/mol, XLogP of 3.42, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,2-difluoroethyl)-3,3-diethyl-1,4-diazaspiro[5.5]undecane is sourced from PubChem (CID 64876676), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).