6-fluorospiro[1,2-dihydroindole-3,1'-cyclohexane]

C13H16FN — CID 115024124

IUPAC6-fluorospiro[1,2-dihydroindole-3,1'-cyclohexane]
SMILESFc1ccc2c(c1)NCC21CCCCC1
InChIInChI=1S/C13H16FN/c14-10-4-5-11-12(8-10)15-9-13(11)6-2-1-3-7-13/h4-5,8,15H,1-3,6-7,9H2
InChIKeySQWOAGCUCUKPAJ-UHFFFAOYSA-N
MW205.28 g/mol
LogP3.45
Rot. Bonds

About 6-fluorospiro[1,2-dihydroindole-3,1'-cyclohexane]

6-fluorospiro[1,2-dihydroindole-3,1'-cyclohexane] (PubChem CID 115024124) has the molecular formula C13H16FN and a molecular weight of 205.28 g/mol. Its IUPAC name is 6-fluorospiro[1,2-dihydroindole-3,1'-cyclohexane].

Molecular Properties

Compound Name6-fluorospiro[1,2-dihydroindole-3,1'-cyclohexane]
PubChem CID115024124
Molecular FormulaC13H16FN
Molecular Weight205.28 g/mol
Exact Mass205.13
IUPAC Name6-fluorospiro[1,2-dihydroindole-3,1'-cyclohexane]
SMILESFc1ccc2c(c1)NCC21CCCCC1
InChIInChI=1S/C13H16FN/c14-10-4-5-11-12(8-10)15-9-13(11)6-2-1-3-7-13/h4-5,8,15H,1-3,6-7,9H2
InChIKeySQWOAGCUCUKPAJ-UHFFFAOYSA-N
XLogP3.45
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.28
LogP ≤ 53.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 6-fluorospiro[1,2-dihydroindole-3,1'-cyclohexane] 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 6-fluorospiro[1,2-dihydroindole-3,1'-cyclohexane]?
The IUPAC name of 6-fluorospiro[1,2-dihydroindole-3,1'-cyclohexane] (CID 115024124) is 6-fluorospiro[1,2-dihydroindole-3,1'-cyclohexane].
What is the SMILES notation for 6-fluorospiro[1,2-dihydroindole-3,1'-cyclohexane]?
The canonical SMILES for 6-fluorospiro[1,2-dihydroindole-3,1'-cyclohexane] is Fc1ccc2c(c1)NCC21CCCCC1.
What is the InChIKey of 6-fluorospiro[1,2-dihydroindole-3,1'-cyclohexane]?
The InChIKey is SQWOAGCUCUKPAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16FN/c14-10-4-5-11-12(8-10)15-9-13(11)6-2-1-3-7-13/h4-5,8,15H,1-3,6-7,9H2.
What are the key properties of 6-fluorospiro[1,2-dihydroindole-3,1'-cyclohexane]?
6-fluorospiro[1,2-dihydroindole-3,1'-cyclohexane] has a molecular weight of 205.28 g/mol, XLogP of 3.45, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluorospiro[1,2-dihydroindole-3,1'-cyclohexane] is sourced from PubChem (CID 115024124), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).