2-ethyl-6-(2-fluoro-2-methylpropyl)-6-azaspiro[3.4]octane

C13H24FN — CID 170740035

IUPAC2-ethyl-6-(2-fluoro-2-methylpropyl)-6-azaspiro[3.4]octane
SMILESCCC1CC2(CCN(CC(C)(C)F)C2)C1
InChIInChI=1S/C13H24FN/c1-4-11-7-13(8-11)5-6-15(10-13)9-12(2,3)14/h11H,4-10H2,1-3H3
InChIKeyGGZXFQNDKBWJOV-UHFFFAOYSA-N
MW213.34 g/mol
LogP3.25
Rot. Bonds3

About 2-ethyl-6-(2-fluoro-2-methylpropyl)-6-azaspiro[3.4]octane

2-ethyl-6-(2-fluoro-2-methylpropyl)-6-azaspiro[3.4]octane (PubChem CID 170740035) has the molecular formula C13H24FN and a molecular weight of 213.34 g/mol. Its IUPAC name is 2-ethyl-6-(2-fluoro-2-methylpropyl)-6-azaspiro[3.4]octane.

Molecular Properties

Compound Name2-ethyl-6-(2-fluoro-2-methylpropyl)-6-azaspiro[3.4]octane
PubChem CID170740035
Molecular FormulaC13H24FN
Molecular Weight213.34 g/mol
Exact Mass213.19
IUPAC Name2-ethyl-6-(2-fluoro-2-methylpropyl)-6-azaspiro[3.4]octane
SMILESCCC1CC2(CCN(CC(C)(C)F)C2)C1
InChIInChI=1S/C13H24FN/c1-4-11-7-13(8-11)5-6-15(10-13)9-12(2,3)14/h11H,4-10H2,1-3H3
InChIKeyGGZXFQNDKBWJOV-UHFFFAOYSA-N
XLogP3.25
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.34
LogP ≤ 53.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 2-ethyl-6-(2-fluoro-2-methylpropyl)-6-azaspiro[3.4]octane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-(3-Fluoropropyl)-1-methylpyrrolidine
CID 18723118
(3R,4R)-3-(2,2-dimethylpropyl)-4-fluoro-1-methylpyrrolidine
CID 58473066
3-Tert-butyl-4-fluoro-1-methylpyrrolidine
CID 58530504
3-Tert-butyl-1-ethyl-4-fluoropyrrolidine
CID 58530553
3-Fluoro-1-methyl-4-(1-methylcyclopropyl)pyrrolidine
CID 58944883
3-Ethyl-3-(fluoromethyl)-1-methylpyrrolidine
CID 58945070
(3S,4S)-3-fluoro-1-methyl-4-(1-methylcyclopropyl)pyrrolidine
CID 59048022
(3S)-3-fluoro-1-[(3-propan-2-ylcyclobutyl)methyl]pyrrolidine
CID 68067653
(3R)-3-fluoro-1-[(3-propan-2-ylcyclobutyl)methyl]pyrrolidine
CID 68067675
3-(2,2-Dimethylpropyl)-4-fluoro-1-methylpyrrolidine
CID 76797082
1-(4,4-Dimethylpentyl)-3-fluoro-3-methylpyrrolidine
CID 118328439
3-(2,2-Dimethylpropyl)-1-(2,2,2-trifluoroethyl)pyrrolidine
CID 121406134

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-6-(2-fluoro-2-methylpropyl)-6-azaspiro[3.4]octane?
The IUPAC name of 2-ethyl-6-(2-fluoro-2-methylpropyl)-6-azaspiro[3.4]octane (CID 170740035) is 2-ethyl-6-(2-fluoro-2-methylpropyl)-6-azaspiro[3.4]octane.
What is the SMILES notation for 2-ethyl-6-(2-fluoro-2-methylpropyl)-6-azaspiro[3.4]octane?
The canonical SMILES for 2-ethyl-6-(2-fluoro-2-methylpropyl)-6-azaspiro[3.4]octane is CCC1CC2(CCN(CC(C)(C)F)C2)C1.
What is the InChIKey of 2-ethyl-6-(2-fluoro-2-methylpropyl)-6-azaspiro[3.4]octane?
The InChIKey is GGZXFQNDKBWJOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24FN/c1-4-11-7-13(8-11)5-6-15(10-13)9-12(2,3)14/h11H,4-10H2,1-3H3.
What are the key properties of 2-ethyl-6-(2-fluoro-2-methylpropyl)-6-azaspiro[3.4]octane?
2-ethyl-6-(2-fluoro-2-methylpropyl)-6-azaspiro[3.4]octane has a molecular weight of 213.34 g/mol, XLogP of 3.25, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-6-(2-fluoro-2-methylpropyl)-6-azaspiro[3.4]octane is sourced from PubChem (CID 170740035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).