6-fluoro-1-methylspiro[2H-indole-3,1'-cyclohexane]

C14H18FN — CID 156796258

IUPAC6-fluoro-1-methylspiro[2H-indole-3,1'-cyclohexane]
SMILESCN1CC2(CCCCC2)c2ccc(F)cc21
InChIInChI=1S/C14H18FN/c1-16-10-14(7-3-2-4-8-14)12-6-5-11(15)9-13(12)16/h5-6,9H,2-4,7-8,10H2,1H3
InChIKeyVCCUXOJSXLZBGA-UHFFFAOYSA-N
MW219.30 g/mol
LogP3.48
Rot. Bonds

About 6-fluoro-1-methylspiro[2H-indole-3,1'-cyclohexane]

6-fluoro-1-methylspiro[2H-indole-3,1'-cyclohexane] (PubChem CID 156796258) has the molecular formula C14H18FN and a molecular weight of 219.30 g/mol. Its IUPAC name is 6-fluoro-1-methylspiro[2H-indole-3,1'-cyclohexane].

Molecular Properties

Compound Name6-fluoro-1-methylspiro[2H-indole-3,1'-cyclohexane]
PubChem CID156796258
Molecular FormulaC14H18FN
Molecular Weight219.30 g/mol
Exact Mass219.14
IUPAC Name6-fluoro-1-methylspiro[2H-indole-3,1'-cyclohexane]
SMILESCN1CC2(CCCCC2)c2ccc(F)cc21
InChIInChI=1S/C14H18FN/c1-16-10-14(7-3-2-4-8-14)12-6-5-11(15)9-13(12)16/h5-6,9H,2-4,7-8,10H2,1H3
InChIKeyVCCUXOJSXLZBGA-UHFFFAOYSA-N
XLogP3.48
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.30
LogP ≤ 53.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

5-fluoro-1,3,3-trimethyl-2H-indole
CID 58386422
7-fluoro-4-methylspiro[1,3-dihydroquinoxaline-2,1'-cyclopentane]
CID 84623646
1-N-[2-(6-fluoro-1-methylspiro[2H-indole-3,4'-cyclohexane]-1'-yl)phenyl]-4-N,4-N-dimethylbenzene-1,4-disulfonamide
CID 165388890
1-(2,4-difluorophenyl)cyclohexan-1-amine
CID 62802198
6-fluorospiro[1,2-dihydroindole-3,1'-cyclohexane]
CID 115024124
7-fluoro-1-methyl-3,4-dihydro-2H-quinoline
CID 129259469
1-(2,4-difluorophenyl)cycloheptane-1-carbonitrile
CID 64560794
1-(4-fluoro-2-methylphenyl)cyclohexan-1-ol
CID 62787600
ethane;7-fluoro-1-methyl-3,4-dihydro-2H-quinoline
CID 145098323
(3S)-1-tert-butyl-5-fluorospiro[2H-indole-3,3'-piperidine]
CID 58172354
(2S,3S)-3-(3-fluorophenyl)-3-spiro[2H-indole-3,1'-cyclopentane]-1-ylpropane-1,2-diol
CID 45139595
2-(2,4-difluorophenyl)-2-propylazepane
CID 79118364

Frequently Asked Questions

What is the IUPAC name of 6-fluoro-1-methylspiro[2H-indole-3,1'-cyclohexane]?
The IUPAC name of 6-fluoro-1-methylspiro[2H-indole-3,1'-cyclohexane] (CID 156796258) is 6-fluoro-1-methylspiro[2H-indole-3,1'-cyclohexane].
What is the SMILES notation for 6-fluoro-1-methylspiro[2H-indole-3,1'-cyclohexane]?
The canonical SMILES for 6-fluoro-1-methylspiro[2H-indole-3,1'-cyclohexane] is CN1CC2(CCCCC2)c2ccc(F)cc21.
What is the InChIKey of 6-fluoro-1-methylspiro[2H-indole-3,1'-cyclohexane]?
The InChIKey is VCCUXOJSXLZBGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18FN/c1-16-10-14(7-3-2-4-8-14)12-6-5-11(15)9-13(12)16/h5-6,9H,2-4,7-8,10H2,1H3.
What are the key properties of 6-fluoro-1-methylspiro[2H-indole-3,1'-cyclohexane]?
6-fluoro-1-methylspiro[2H-indole-3,1'-cyclohexane] has a molecular weight of 219.30 g/mol, XLogP of 3.48, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-1-methylspiro[2H-indole-3,1'-cyclohexane] is sourced from PubChem (CID 156796258), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).