10-(2,2-difluoroethyl)-9-methyl-6,10-diazaspiro[4.6]undecane

C12H22F2N2 — CID 64872193

IUPAC10-(2,2-difluoroethyl)-9-methyl-6,10-diazaspiro[4.6]undecane
SMILESCC1CCNC2(CCCC2)CN1CC(F)F
InChIInChI=1S/C12H22F2N2/c1-10-4-7-15-12(5-2-3-6-12)9-16(10)8-11(13)14/h10-11,15H,2-9H2,1H3
InChIKeyNLFZUUXLYKKXBV-UHFFFAOYSA-N
MW232.32 g/mol
LogP2.25
Rot. Bonds2

About 10-(2,2-difluoroethyl)-9-methyl-6,10-diazaspiro[4.6]undecane

10-(2,2-difluoroethyl)-9-methyl-6,10-diazaspiro[4.6]undecane (PubChem CID 64872193) has the molecular formula C12H22F2N2 and a molecular weight of 232.32 g/mol. Its IUPAC name is 10-(2,2-difluoroethyl)-9-methyl-6,10-diazaspiro[4.6]undecane.

Molecular Properties

Compound Name10-(2,2-difluoroethyl)-9-methyl-6,10-diazaspiro[4.6]undecane
PubChem CID64872193
Molecular FormulaC12H22F2N2
Molecular Weight232.32 g/mol
Exact Mass232.18
IUPAC Name10-(2,2-difluoroethyl)-9-methyl-6,10-diazaspiro[4.6]undecane
SMILESCC1CCNC2(CCCC2)CN1CC(F)F
InChIInChI=1S/C12H22F2N2/c1-10-4-7-15-12(5-2-3-6-12)9-16(10)8-11(13)14/h10-11,15H,2-9H2,1H3
InChIKeyNLFZUUXLYKKXBV-UHFFFAOYSA-N
XLogP2.25
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.32
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 10-(2,2-difluoroethyl)-9-methyl-6,10-diazaspiro[4.6]undecane?
The IUPAC name of 10-(2,2-difluoroethyl)-9-methyl-6,10-diazaspiro[4.6]undecane (CID 64872193) is 10-(2,2-difluoroethyl)-9-methyl-6,10-diazaspiro[4.6]undecane.
What is the SMILES notation for 10-(2,2-difluoroethyl)-9-methyl-6,10-diazaspiro[4.6]undecane?
The canonical SMILES for 10-(2,2-difluoroethyl)-9-methyl-6,10-diazaspiro[4.6]undecane is CC1CCNC2(CCCC2)CN1CC(F)F.
What is the InChIKey of 10-(2,2-difluoroethyl)-9-methyl-6,10-diazaspiro[4.6]undecane?
The InChIKey is NLFZUUXLYKKXBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22F2N2/c1-10-4-7-15-12(5-2-3-6-12)9-16(10)8-11(13)14/h10-11,15H,2-9H2,1H3.
What are the key properties of 10-(2,2-difluoroethyl)-9-methyl-6,10-diazaspiro[4.6]undecane?
10-(2,2-difluoroethyl)-9-methyl-6,10-diazaspiro[4.6]undecane has a molecular weight of 232.32 g/mol, XLogP of 2.25, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 10-(2,2-difluoroethyl)-9-methyl-6,10-diazaspiro[4.6]undecane is sourced from PubChem (CID 64872193), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).