[2-(2-azaspiro[3.4]octan-2-yl)-6-fluorophenyl]methanamine

C14H19FN2 — CID 79687416

IUPAC[2-(2-azaspiro[3.4]octan-2-yl)-6-fluorophenyl]methanamine
SMILESNCc1c(F)cccc1N1CC2(CCCC2)C1
InChIInChI=1S/C14H19FN2/c15-12-4-3-5-13(11(12)8-16)17-9-14(10-17)6-1-2-7-14/h3-5H,1-2,6-10,16H2
InChIKeyMEALXOYDGRNNOB-UHFFFAOYSA-N
MW234.32 g/mol
LogP2.66
Rot. Bonds2

About [2-(2-azaspiro[3.4]octan-2-yl)-6-fluorophenyl]methanamine

[2-(2-azaspiro[3.4]octan-2-yl)-6-fluorophenyl]methanamine (PubChem CID 79687416) has the molecular formula C14H19FN2 and a molecular weight of 234.32 g/mol. Its IUPAC name is [2-(2-azaspiro[3.4]octan-2-yl)-6-fluorophenyl]methanamine.

Molecular Properties

Compound Name[2-(2-azaspiro[3.4]octan-2-yl)-6-fluorophenyl]methanamine
PubChem CID79687416
Molecular FormulaC14H19FN2
Molecular Weight234.32 g/mol
Exact Mass234.15
IUPAC Name[2-(2-azaspiro[3.4]octan-2-yl)-6-fluorophenyl]methanamine
SMILESNCc1c(F)cccc1N1CC2(CCCC2)C1
InChIInChI=1S/C14H19FN2/c15-12-4-3-5-13(11(12)8-16)17-9-14(10-17)6-1-2-7-14/h3-5H,1-2,6-10,16H2
InChIKeyMEALXOYDGRNNOB-UHFFFAOYSA-N
XLogP2.66
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.32
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze [2-(2-azaspiro[3.4]octan-2-yl)-6-fluorophenyl]methanamine with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of [2-(2-azaspiro[3.4]octan-2-yl)-6-fluorophenyl]methanamine?
The IUPAC name of [2-(2-azaspiro[3.4]octan-2-yl)-6-fluorophenyl]methanamine (CID 79687416) is [2-(2-azaspiro[3.4]octan-2-yl)-6-fluorophenyl]methanamine.
What is the SMILES notation for [2-(2-azaspiro[3.4]octan-2-yl)-6-fluorophenyl]methanamine?
The canonical SMILES for [2-(2-azaspiro[3.4]octan-2-yl)-6-fluorophenyl]methanamine is NCc1c(F)cccc1N1CC2(CCCC2)C1.
What is the InChIKey of [2-(2-azaspiro[3.4]octan-2-yl)-6-fluorophenyl]methanamine?
The InChIKey is MEALXOYDGRNNOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19FN2/c15-12-4-3-5-13(11(12)8-16)17-9-14(10-17)6-1-2-7-14/h3-5H,1-2,6-10,16H2.
What are the key properties of [2-(2-azaspiro[3.4]octan-2-yl)-6-fluorophenyl]methanamine?
[2-(2-azaspiro[3.4]octan-2-yl)-6-fluorophenyl]methanamine has a molecular weight of 234.32 g/mol, XLogP of 2.66, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2-azaspiro[3.4]octan-2-yl)-6-fluorophenyl]methanamine is sourced from PubChem (CID 79687416), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).