1'-methyl-2-(2-phenylphenyl)spiro[1,2-dihydroindole-3,4'-piperidine]

C25H26N2 — CID 12733516

IUPAC1'-methyl-2-(2-phenylphenyl)spiro[1,2-dihydroindole-3,4'-piperidine]
SMILESCN1CCC2(CC1)c1ccccc1NC2c1ccccc1-c1ccccc1
InChIInChI=1S/C25H26N2/c1-27-17-15-25(16-18-27)22-13-7-8-14-23(22)26-24(25)21-12-6-5-11-20(21)19-9-3-2-4-10-19/h2-14,24,26H,15-18H2,1H3
InChIKeyDFKHHDFSVFMIKI-UHFFFAOYSA-N
MW354.50 g/mol
LogP5.48
Rot. Bonds2

About 1'-methyl-2-(2-phenylphenyl)spiro[1,2-dihydroindole-3,4'-piperidine]

1'-methyl-2-(2-phenylphenyl)spiro[1,2-dihydroindole-3,4'-piperidine] (PubChem CID 12733516) has the molecular formula C25H26N2 and a molecular weight of 354.50 g/mol. Its IUPAC name is 1'-methyl-2-(2-phenylphenyl)spiro[1,2-dihydroindole-3,4'-piperidine].

Molecular Properties

Compound Name1'-methyl-2-(2-phenylphenyl)spiro[1,2-dihydroindole-3,4'-piperidine]
PubChem CID12733516
Molecular FormulaC25H26N2
Molecular Weight354.50 g/mol
Exact Mass354.21
IUPAC Name1'-methyl-2-(2-phenylphenyl)spiro[1,2-dihydroindole-3,4'-piperidine]
SMILESCN1CCC2(CC1)c1ccccc1NC2c1ccccc1-c1ccccc1
InChIInChI=1S/C25H26N2/c1-27-17-15-25(16-18-27)22-13-7-8-14-23(22)26-24(25)21-12-6-5-11-20(21)19-9-3-2-4-10-19/h2-14,24,26H,15-18H2,1H3
InChIKeyDFKHHDFSVFMIKI-UHFFFAOYSA-N
XLogP5.48
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500354.50
LogP ≤ 55.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1'-propan-2-ylspiro[1,2-dihydroindole-3,4'-piperidine]-2-ol
CID 134383306
ethane;1'-methylspiro[1H-2,1-benzothiazole-3,4'-piperidine] 2,2-dioxide
CID 176678082
1-tert-butyl-2-(2-phenylphenyl)pyrrolidine
CID 158841914
azane;1-cyclopropyl-2-phenylbenzene
CID 174547513
[(1S,3R,3aR,6aS)-5-methyl-3-(2-methylpropyl)-1-(2-phenylphenyl)-1,2,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrol-3-yl]methanol
CID 50951413
2-(4-fluorophenyl)-1'-methylspiro[2H-1-benzofuran-3,4'-piperidine]
CID 12733490
1,1'-dimethylspiro[1H-isochromene-4,4'-piperidine]-3-one
CID 14976651
1-cyclobutyl-2-phenylbenzene
CID 23453799
2,8-dimethyl-4-phenyl-2,8-diazaspiro[4.5]decane-1,3-dione
CID 165353119
1-[(1R,2S)-2-methylcyclobutyl]-2-phenylbenzene
CID 162408890
2,2,6,6-tetramethyl-4-(2-phenylphenyl)piperidine
CID 150838395
1',3-dimethylspiro[1H-quinazoline-2,4'-piperidine]-4-one
CID 134113619

Frequently Asked Questions

What is the IUPAC name of 1'-methyl-2-(2-phenylphenyl)spiro[1,2-dihydroindole-3,4'-piperidine]?
The IUPAC name of 1'-methyl-2-(2-phenylphenyl)spiro[1,2-dihydroindole-3,4'-piperidine] (CID 12733516) is 1'-methyl-2-(2-phenylphenyl)spiro[1,2-dihydroindole-3,4'-piperidine].
What is the SMILES notation for 1'-methyl-2-(2-phenylphenyl)spiro[1,2-dihydroindole-3,4'-piperidine]?
The canonical SMILES for 1'-methyl-2-(2-phenylphenyl)spiro[1,2-dihydroindole-3,4'-piperidine] is CN1CCC2(CC1)c1ccccc1NC2c1ccccc1-c1ccccc1.
What is the InChIKey of 1'-methyl-2-(2-phenylphenyl)spiro[1,2-dihydroindole-3,4'-piperidine]?
The InChIKey is DFKHHDFSVFMIKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H26N2/c1-27-17-15-25(16-18-27)22-13-7-8-14-23(22)26-24(25)21-12-6-5-11-20(21)19-9-3-2-4-10-19/h2-14,24,26H,15-18H2,1H3.
What are the key properties of 1'-methyl-2-(2-phenylphenyl)spiro[1,2-dihydroindole-3,4'-piperidine]?
1'-methyl-2-(2-phenylphenyl)spiro[1,2-dihydroindole-3,4'-piperidine] has a molecular weight of 354.50 g/mol, XLogP of 5.48, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1'-methyl-2-(2-phenylphenyl)spiro[1,2-dihydroindole-3,4'-piperidine] is sourced from PubChem (CID 12733516), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).