1,1'-dimethyl-5-(trifluoromethyl)spiro[2H-indole-3,4'-piperidine]

C15H19F3N2 — CID 70927045

IUPAC1,1'-dimethyl-5-(trifluoromethyl)spiro[2H-indole-3,4'-piperidine]
SMILESCN1CCC2(CC1)CN(C)c1ccc(C(F)(F)F)cc12
InChIInChI=1S/C15H19F3N2/c1-19-7-5-14(6-8-19)10-20(2)13-4-3-11(9-12(13)14)15(16,17)18/h3-4,9H,5-8,10H2,1-2H3
InChIKeyFCUCXIZATVEMEA-UHFFFAOYSA-N
MW284.32 g/mol
LogP3.12
Rot. Bonds

About 1,1'-dimethyl-5-(trifluoromethyl)spiro[2H-indole-3,4'-piperidine]

1,1'-dimethyl-5-(trifluoromethyl)spiro[2H-indole-3,4'-piperidine] (PubChem CID 70927045) has the molecular formula C15H19F3N2 and a molecular weight of 284.32 g/mol. Its IUPAC name is 1,1'-dimethyl-5-(trifluoromethyl)spiro[2H-indole-3,4'-piperidine].

Molecular Properties

Compound Name1,1'-dimethyl-5-(trifluoromethyl)spiro[2H-indole-3,4'-piperidine]
PubChem CID70927045
Molecular FormulaC15H19F3N2
Molecular Weight284.32 g/mol
Exact Mass284.15
IUPAC Name1,1'-dimethyl-5-(trifluoromethyl)spiro[2H-indole-3,4'-piperidine]
SMILESCN1CCC2(CC1)CN(C)c1ccc(C(F)(F)F)cc12
InChIInChI=1S/C15H19F3N2/c1-19-7-5-14(6-8-19)10-20(2)13-4-3-11(9-12(13)14)15(16,17)18/h3-4,9H,5-8,10H2,1-2H3
InChIKeyFCUCXIZATVEMEA-UHFFFAOYSA-N
XLogP3.12
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.32
LogP ≤ 53.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1,1'-dimethyl-5-(trifluoromethyl)spiro[2H-indole-3,4'-piperidine]?
The IUPAC name of 1,1'-dimethyl-5-(trifluoromethyl)spiro[2H-indole-3,4'-piperidine] (CID 70927045) is 1,1'-dimethyl-5-(trifluoromethyl)spiro[2H-indole-3,4'-piperidine].
What is the SMILES notation for 1,1'-dimethyl-5-(trifluoromethyl)spiro[2H-indole-3,4'-piperidine]?
The canonical SMILES for 1,1'-dimethyl-5-(trifluoromethyl)spiro[2H-indole-3,4'-piperidine] is CN1CCC2(CC1)CN(C)c1ccc(C(F)(F)F)cc12.
What is the InChIKey of 1,1'-dimethyl-5-(trifluoromethyl)spiro[2H-indole-3,4'-piperidine]?
The InChIKey is FCUCXIZATVEMEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19F3N2/c1-19-7-5-14(6-8-19)10-20(2)13-4-3-11(9-12(13)14)15(16,17)18/h3-4,9H,5-8,10H2,1-2H3.
What are the key properties of 1,1'-dimethyl-5-(trifluoromethyl)spiro[2H-indole-3,4'-piperidine]?
1,1'-dimethyl-5-(trifluoromethyl)spiro[2H-indole-3,4'-piperidine] has a molecular weight of 284.32 g/mol, XLogP of 3.12, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1'-dimethyl-5-(trifluoromethyl)spiro[2H-indole-3,4'-piperidine] is sourced from PubChem (CID 70927045), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).