6-fluoro-2,6-dimethyl-2-azaspiro[3.3]heptane

C8H14FN — CID 121313305

IUPAC6-fluoro-2,6-dimethyl-2-azaspiro[3.3]heptane
SMILESCN1CC2(C1)CC(C)(F)C2
InChIInChI=1S/C8H14FN/c1-7(9)3-8(4-7)5-10(2)6-8/h3-6H2,1-2H3
InChIKeyAZSMIWKBDKQAAX-UHFFFAOYSA-N
MW143.20 g/mol
LogP1.44
Rot. Bonds

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

6-fluoro-2,6-dimethyl-2-azaspiro[3.3]heptane (PubChem CID 121313305) has the molecular formula C8H14FN and a molecular weight of 143.20 g/mol. Its IUPAC name is 6-fluoro-2,6-dimethyl-2-azaspiro[3.3]heptane.

Molecular Properties

Compound Name6-fluoro-2,6-dimethyl-2-azaspiro[3.3]heptane
PubChem CID121313305
Molecular FormulaC8H14FN
Molecular Weight143.20 g/mol
Exact Mass143.11
IUPAC Name6-fluoro-2,6-dimethyl-2-azaspiro[3.3]heptane
SMILESCN1CC2(C1)CC(C)(F)C2
InChIInChI=1S/C8H14FN/c1-7(9)3-8(4-7)5-10(2)6-8/h3-6H2,1-2H3
InChIKeyAZSMIWKBDKQAAX-UHFFFAOYSA-N
XLogP1.44
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.20
LogP ≤ 51.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 6-fluoro-2,6-dimethyl-2-azaspiro[3.3]heptane?
The IUPAC name of 6-fluoro-2,6-dimethyl-2-azaspiro[3.3]heptane (CID 121313305) is 6-fluoro-2,6-dimethyl-2-azaspiro[3.3]heptane.
What is the SMILES notation for 6-fluoro-2,6-dimethyl-2-azaspiro[3.3]heptane?
The canonical SMILES for 6-fluoro-2,6-dimethyl-2-azaspiro[3.3]heptane is CN1CC2(C1)CC(C)(F)C2.
What is the InChIKey of 6-fluoro-2,6-dimethyl-2-azaspiro[3.3]heptane?
The InChIKey is AZSMIWKBDKQAAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14FN/c1-7(9)3-8(4-7)5-10(2)6-8/h3-6H2,1-2H3.
What are the key properties of 6-fluoro-2,6-dimethyl-2-azaspiro[3.3]heptane?
6-fluoro-2,6-dimethyl-2-azaspiro[3.3]heptane has a molecular weight of 143.20 g/mol, XLogP of 1.44, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-2,6-dimethyl-2-azaspiro[3.3]heptane is sourced from PubChem (CID 121313305), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).