3,3-difluoro-1,7-diazaspiro[3.4]octane

C6H10F2N2 — CID 58293346

IUPAC3,3-difluoro-1,7-diazaspiro[3.4]octane
SMILESFC1(F)CNC12CCNC2
InChIInChI=1S/C6H10F2N2/c7-6(8)4-10-5(6)1-2-9-3-5/h9-10H,1-4H2
InChIKeyIVYGBPSGSZGLQT-UHFFFAOYSA-N
MW148.16 g/mol
LogP-0.04
Rot. Bonds

About 3,3-difluoro-1,7-diazaspiro[3.4]octane

3,3-difluoro-1,7-diazaspiro[3.4]octane (PubChem CID 58293346) has the molecular formula C6H10F2N2 and a molecular weight of 148.16 g/mol. Its IUPAC name is 3,3-difluoro-1,7-diazaspiro[3.4]octane.

Molecular Properties

Compound Name3,3-difluoro-1,7-diazaspiro[3.4]octane
PubChem CID58293346
Molecular FormulaC6H10F2N2
Molecular Weight148.16 g/mol
Exact Mass148.08
IUPAC Name3,3-difluoro-1,7-diazaspiro[3.4]octane
SMILESFC1(F)CNC12CCNC2
InChIInChI=1S/C6H10F2N2/c7-6(8)4-10-5(6)1-2-9-3-5/h9-10H,1-4H2
InChIKeyIVYGBPSGSZGLQT-UHFFFAOYSA-N
XLogP-0.04
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.16
LogP ≤ 5-0.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3,3-difluoro-1,7-diazaspiro[3.4]octane?
The IUPAC name of 3,3-difluoro-1,7-diazaspiro[3.4]octane (CID 58293346) is 3,3-difluoro-1,7-diazaspiro[3.4]octane.
What is the SMILES notation for 3,3-difluoro-1,7-diazaspiro[3.4]octane?
The canonical SMILES for 3,3-difluoro-1,7-diazaspiro[3.4]octane is FC1(F)CNC12CCNC2.
What is the InChIKey of 3,3-difluoro-1,7-diazaspiro[3.4]octane?
The InChIKey is IVYGBPSGSZGLQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10F2N2/c7-6(8)4-10-5(6)1-2-9-3-5/h9-10H,1-4H2.
What are the key properties of 3,3-difluoro-1,7-diazaspiro[3.4]octane?
3,3-difluoro-1,7-diazaspiro[3.4]octane has a molecular weight of 148.16 g/mol, XLogP of -0.04, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3-difluoro-1,7-diazaspiro[3.4]octane is sourced from PubChem (CID 58293346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).