6-fluoro-2-azaspiro[3.3]heptane

C6H10FN — CID 54595511

IUPAC6-fluoro-2-azaspiro[3.3]heptane
SMILESFC1CC2(CNC2)C1
InChIInChI=1S/C6H10FN/c7-5-1-6(2-5)3-8-4-6/h5,8H,1-4H2
InChIKeyRCAFANHNHZOIQN-UHFFFAOYSA-N
MW115.15 g/mol
LogP0.71
Rot. Bonds

About 6-fluoro-2-azaspiro[3.3]heptane

6-fluoro-2-azaspiro[3.3]heptane (PubChem CID 54595511) has the molecular formula C6H10FN and a molecular weight of 115.15 g/mol. Its IUPAC name is 6-fluoro-2-azaspiro[3.3]heptane.

Molecular Properties

Compound Name6-fluoro-2-azaspiro[3.3]heptane
PubChem CID54595511
Molecular FormulaC6H10FN
Molecular Weight115.15 g/mol
Exact Mass115.08
IUPAC Name6-fluoro-2-azaspiro[3.3]heptane
SMILESFC1CC2(CNC2)C1
InChIInChI=1S/C6H10FN/c7-5-1-6(2-5)3-8-4-6/h5,8H,1-4H2
InChIKeyRCAFANHNHZOIQN-UHFFFAOYSA-N
XLogP0.71
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500115.15
LogP ≤ 50.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 6-fluoro-2-azaspiro[3.3]heptane?
The IUPAC name of 6-fluoro-2-azaspiro[3.3]heptane (CID 54595511) is 6-fluoro-2-azaspiro[3.3]heptane.
What is the SMILES notation for 6-fluoro-2-azaspiro[3.3]heptane?
The canonical SMILES for 6-fluoro-2-azaspiro[3.3]heptane is FC1CC2(CNC2)C1.
What is the InChIKey of 6-fluoro-2-azaspiro[3.3]heptane?
The InChIKey is RCAFANHNHZOIQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10FN/c7-5-1-6(2-5)3-8-4-6/h5,8H,1-4H2.
What are the key properties of 6-fluoro-2-azaspiro[3.3]heptane?
6-fluoro-2-azaspiro[3.3]heptane has a molecular weight of 115.15 g/mol, XLogP of 0.71, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-2-azaspiro[3.3]heptane is sourced from PubChem (CID 54595511), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).