6,6-difluoro-3-methyl-2-propan-2-yl-3-azabicyclo[3.1.0]hexane;2,2-difluoro-5-methyl-6-propan-2-yl-5-azaspiro[2.4]heptane

C19H32F4N2 — CID 167692269

IUPAC6,6-difluoro-3-methyl-2-propan-2-yl-3-azabicyclo[3.1.0]hexane;2,2-difluoro-5-methyl-6-propan-2-yl-5-azaspiro[2.4]heptane
SMILESCC(C)C1C2C(CN1C)C2(F)F.CC(C)C1CC2(CN1C)CC2(F)F
InChIInChI=1S/C10H17F2N.C9H15F2N/c1-7(2)8-4-9(6-13(8)3)5-10(9,11)12;1-5(2)8-7-6(4-12(8)3)9(7,10)11/h7-8H,4-6H2,1-3H3;5-8H,4H2,1-3H3
InChIKeyXCXAQPDCWUMIDC-UHFFFAOYSA-N
MW364.47 g/mol
LogP4.21
Rot. Bonds2

About 6,6-difluoro-3-methyl-2-propan-2-yl-3-azabicyclo[3.1.0]hexane;2,2-difluoro-5-methyl-6-propan-2-yl-5-azaspiro[2.4]heptane

6,6-difluoro-3-methyl-2-propan-2-yl-3-azabicyclo[3.1.0]hexane;2,2-difluoro-5-methyl-6-propan-2-yl-5-azaspiro[2.4]heptane (PubChem CID 167692269) has the molecular formula C19H32F4N2 and a molecular weight of 364.47 g/mol. Its IUPAC name is 6,6-difluoro-3-methyl-2-propan-2-yl-3-azabicyclo[3.1.0]hexane;2,2-difluoro-5-methyl-6-propan-2-yl-5-azaspiro[2.4]heptane.

Molecular Properties

Compound Name6,6-difluoro-3-methyl-2-propan-2-yl-3-azabicyclo[3.1.0]hexane;2,2-difluoro-5-methyl-6-propan-2-yl-5-azaspiro[2.4]heptane
PubChem CID167692269
Molecular FormulaC19H32F4N2
Molecular Weight364.47 g/mol
Exact Mass364.25
IUPAC Name6,6-difluoro-3-methyl-2-propan-2-yl-3-azabicyclo[3.1.0]hexane;2,2-difluoro-5-methyl-6-propan-2-yl-5-azaspiro[2.4]heptane
SMILESCC(C)C1C2C(CN1C)C2(F)F.CC(C)C1CC2(CN1C)CC2(F)F
InChIInChI=1S/C10H17F2N.C9H15F2N/c1-7(2)8-4-9(6-13(8)3)5-10(9,11)12;1-5(2)8-7-6(4-12(8)3)9(7,10)11/h7-8H,4-6H2,1-3H3;5-8H,4H2,1-3H3
InChIKeyXCXAQPDCWUMIDC-UHFFFAOYSA-N
XLogP4.21
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.47
LogP ≤ 54.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 6,6-difluoro-3-methyl-2-propan-2-yl-3-azabicyclo[3.1.0]hexane;2,2-difluoro-5-methyl-6-propan-2-yl-5-azaspiro[2.4]heptane with MolForge

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Frequently Asked Questions

What is the IUPAC name of 6,6-difluoro-3-methyl-2-propan-2-yl-3-azabicyclo[3.1.0]hexane;2,2-difluoro-5-methyl-6-propan-2-yl-5-azaspiro[2.4]heptane?
The IUPAC name of 6,6-difluoro-3-methyl-2-propan-2-yl-3-azabicyclo[3.1.0]hexane;2,2-difluoro-5-methyl-6-propan-2-yl-5-azaspiro[2.4]heptane (CID 167692269) is 6,6-difluoro-3-methyl-2-propan-2-yl-3-azabicyclo[3.1.0]hexane;2,2-difluoro-5-methyl-6-propan-2-yl-5-azaspiro[2.4]heptane.
What is the SMILES notation for 6,6-difluoro-3-methyl-2-propan-2-yl-3-azabicyclo[3.1.0]hexane;2,2-difluoro-5-methyl-6-propan-2-yl-5-azaspiro[2.4]heptane?
The canonical SMILES for 6,6-difluoro-3-methyl-2-propan-2-yl-3-azabicyclo[3.1.0]hexane;2,2-difluoro-5-methyl-6-propan-2-yl-5-azaspiro[2.4]heptane is CC(C)C1C2C(CN1C)C2(F)F.CC(C)C1CC2(CN1C)CC2(F)F.
What is the InChIKey of 6,6-difluoro-3-methyl-2-propan-2-yl-3-azabicyclo[3.1.0]hexane;2,2-difluoro-5-methyl-6-propan-2-yl-5-azaspiro[2.4]heptane?
The InChIKey is XCXAQPDCWUMIDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17F2N.C9H15F2N/c1-7(2)8-4-9(6-13(8)3)5-10(9,11)12;1-5(2)8-7-6(4-12(8)3)9(7,10)11/h7-8H,4-6H2,1-3H3;5-8H,4H2,1-3H3.
What are the key properties of 6,6-difluoro-3-methyl-2-propan-2-yl-3-azabicyclo[3.1.0]hexane;2,2-difluoro-5-methyl-6-propan-2-yl-5-azaspiro[2.4]heptane?
6,6-difluoro-3-methyl-2-propan-2-yl-3-azabicyclo[3.1.0]hexane;2,2-difluoro-5-methyl-6-propan-2-yl-5-azaspiro[2.4]heptane has a molecular weight of 364.47 g/mol, XLogP of 4.21, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6,6-difluoro-3-methyl-2-propan-2-yl-3-azabicyclo[3.1.0]hexane;2,2-difluoro-5-methyl-6-propan-2-yl-5-azaspiro[2.4]heptane is sourced from PubChem (CID 167692269), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).