1-(2-methylpropyl)spiro[2H-indole-3,4'-piperidine]

C16H24N2 — CID 83980527

IUPAC1-(2-methylpropyl)spiro[2H-indole-3,4'-piperidine]
SMILESCC(C)CN1CC2(CCNCC2)c2ccccc21
InChIInChI=1S/C16H24N2/c1-13(2)11-18-12-16(7-9-17-10-8-16)14-5-3-4-6-15(14)18/h3-6,13,17H,7-12H2,1-2H3
InChIKeyQPKWMEKNPOWRSC-UHFFFAOYSA-N
MW244.38 g/mol
LogP2.78
Rot. Bonds2

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

1-(2-methylpropyl)spiro[2H-indole-3,4'-piperidine] (PubChem CID 83980527) has the molecular formula C16H24N2 and a molecular weight of 244.38 g/mol. Its IUPAC name is 1-(2-methylpropyl)spiro[2H-indole-3,4'-piperidine].

Molecular Properties

Compound Name1-(2-methylpropyl)spiro[2H-indole-3,4'-piperidine]
PubChem CID83980527
Molecular FormulaC16H24N2
Molecular Weight244.38 g/mol
Exact Mass244.19
IUPAC Name1-(2-methylpropyl)spiro[2H-indole-3,4'-piperidine]
SMILESCC(C)CN1CC2(CCNCC2)c2ccccc21
InChIInChI=1S/C16H24N2/c1-13(2)11-18-12-16(7-9-17-10-8-16)14-5-3-4-6-15(14)18/h3-6,13,17H,7-12H2,1-2H3
InChIKeyQPKWMEKNPOWRSC-UHFFFAOYSA-N
XLogP2.78
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.38
LogP ≤ 52.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2,2-dimethyl-1-spiro[2H-indole-3,4'-piperidine]-1-ylpropan-1-one
CID 57041656
1-benzylspiro[3,4-dihydro-2H-1-benzazepine-5,4'-piperidine]
CID 82626814
1-benzyl-5,6-dimethylspiro[2H-indole-3,4'-piperidine]
CID 83980538
1-(2-methylpropyl)spiro[4,5-dihydro-2H-1,4-benzodiazepine-3,1'-cyclopentane]
CID 79908018
2-methyl-1-spiro[2H-indole-3,1'-cyclobutane]-1-ylpropan-2-amine
CID 120857821
1-(2-nitrophenyl)spiro[2H-indole-3,4'-piperidine]
CID 12801637
3-piperidin-4-yl-1-spiro[2H-indole-3,1'-cyclopropane]-1-ylbutan-1-one
CID 119791577
1-(2-methylpropyl)-2,3,4,5-tetrahydro-1,4-benzodiazepine
CID 63101229
2-(cyclopropylmethyl)spiro[3H-isoquinoline-4,4'-piperidine]-1-one
CID 22380612
3,3-diethyl-1-(2-methylpropyl)-4,5-dihydro-2H-1,4-benzodiazepine
CID 79909672
(3S)-1-(2-methylpropyl)spiro[4H-quinoline-3,3'-pyrrolidine]-2-one
CID 97449361
(3R)-1-(2-methylpropyl)spiro[4H-quinoline-3,3'-pyrrolidine]-2-one
CID 97449360

Frequently Asked Questions

What is the IUPAC name of 1-(2-methylpropyl)spiro[2H-indole-3,4'-piperidine]?
The IUPAC name of 1-(2-methylpropyl)spiro[2H-indole-3,4'-piperidine] (CID 83980527) is 1-(2-methylpropyl)spiro[2H-indole-3,4'-piperidine].
What is the SMILES notation for 1-(2-methylpropyl)spiro[2H-indole-3,4'-piperidine]?
The canonical SMILES for 1-(2-methylpropyl)spiro[2H-indole-3,4'-piperidine] is CC(C)CN1CC2(CCNCC2)c2ccccc21.
What is the InChIKey of 1-(2-methylpropyl)spiro[2H-indole-3,4'-piperidine]?
The InChIKey is QPKWMEKNPOWRSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2/c1-13(2)11-18-12-16(7-9-17-10-8-16)14-5-3-4-6-15(14)18/h3-6,13,17H,7-12H2,1-2H3.
What are the key properties of 1-(2-methylpropyl)spiro[2H-indole-3,4'-piperidine]?
1-(2-methylpropyl)spiro[2H-indole-3,4'-piperidine] has a molecular weight of 244.38 g/mol, XLogP of 2.78, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methylpropyl)spiro[2H-indole-3,4'-piperidine] is sourced from PubChem (CID 83980527), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).