9,9-difluoro-7-methyl-2-propan-2-yl-2,7-diazaspiro[4.4]nonane

C11H20F2N2 — CID 176992884

IUPAC9,9-difluoro-7-methyl-2-propan-2-yl-2,7-diazaspiro[4.4]nonane
SMILESCC(C)N1CCC2(CN(C)CC2(F)F)C1
InChIInChI=1S/C11H20F2N2/c1-9(2)15-5-4-10(7-15)6-14(3)8-11(10,12)13/h9H,4-8H2,1-3H3
InChIKeyXKTCPBKTBUGATF-UHFFFAOYSA-N
MW218.29 g/mol
LogP1.67
Rot. Bonds1

About 9,9-difluoro-7-methyl-2-propan-2-yl-2,7-diazaspiro[4.4]nonane

9,9-difluoro-7-methyl-2-propan-2-yl-2,7-diazaspiro[4.4]nonane (PubChem CID 176992884) has the molecular formula C11H20F2N2 and a molecular weight of 218.29 g/mol. Its IUPAC name is 9,9-difluoro-7-methyl-2-propan-2-yl-2,7-diazaspiro[4.4]nonane.

Molecular Properties

Compound Name9,9-difluoro-7-methyl-2-propan-2-yl-2,7-diazaspiro[4.4]nonane
PubChem CID176992884
Molecular FormulaC11H20F2N2
Molecular Weight218.29 g/mol
Exact Mass218.16
IUPAC Name9,9-difluoro-7-methyl-2-propan-2-yl-2,7-diazaspiro[4.4]nonane
SMILESCC(C)N1CCC2(CN(C)CC2(F)F)C1
InChIInChI=1S/C11H20F2N2/c1-9(2)15-5-4-10(7-15)6-14(3)8-11(10,12)13/h9H,4-8H2,1-3H3
InChIKeyXKTCPBKTBUGATF-UHFFFAOYSA-N
XLogP1.67
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.29
LogP ≤ 51.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 9,9-difluoro-7-methyl-2-propan-2-yl-2,7-diazaspiro[4.4]nonane with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 9,9-difluoro-7-methyl-2-propan-2-yl-2,7-diazaspiro[4.4]nonane?
The IUPAC name of 9,9-difluoro-7-methyl-2-propan-2-yl-2,7-diazaspiro[4.4]nonane (CID 176992884) is 9,9-difluoro-7-methyl-2-propan-2-yl-2,7-diazaspiro[4.4]nonane.
What is the SMILES notation for 9,9-difluoro-7-methyl-2-propan-2-yl-2,7-diazaspiro[4.4]nonane?
The canonical SMILES for 9,9-difluoro-7-methyl-2-propan-2-yl-2,7-diazaspiro[4.4]nonane is CC(C)N1CCC2(CN(C)CC2(F)F)C1.
What is the InChIKey of 9,9-difluoro-7-methyl-2-propan-2-yl-2,7-diazaspiro[4.4]nonane?
The InChIKey is XKTCPBKTBUGATF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20F2N2/c1-9(2)15-5-4-10(7-15)6-14(3)8-11(10,12)13/h9H,4-8H2,1-3H3.
What are the key properties of 9,9-difluoro-7-methyl-2-propan-2-yl-2,7-diazaspiro[4.4]nonane?
9,9-difluoro-7-methyl-2-propan-2-yl-2,7-diazaspiro[4.4]nonane has a molecular weight of 218.29 g/mol, XLogP of 1.67, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9,9-difluoro-7-methyl-2-propan-2-yl-2,7-diazaspiro[4.4]nonane is sourced from PubChem (CID 176992884), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).