1',6-di(propan-2-yl)spiro[1,2-dihydroindene-3,4'-piperidine]

C19H29N — CID 170688151

IUPAC1',6-di(propan-2-yl)spiro[1,2-dihydroindene-3,4'-piperidine]
SMILESCC(C)c1ccc2c(c1)CCC21CCN(C(C)C)CC1
InChIInChI=1S/C19H29N/c1-14(2)16-5-6-18-17(13-16)7-8-19(18)9-11-20(12-10-19)15(3)4/h5-6,13-15H,7-12H2,1-4H3
InChIKeyABQPFGCUJNOIMS-UHFFFAOYSA-N
MW271.45 g/mol
LogP4.50
Rot. Bonds2

About 1',6-di(propan-2-yl)spiro[1,2-dihydroindene-3,4'-piperidine]

1',6-di(propan-2-yl)spiro[1,2-dihydroindene-3,4'-piperidine] (PubChem CID 170688151) has the molecular formula C19H29N and a molecular weight of 271.45 g/mol. Its IUPAC name is 1',6-di(propan-2-yl)spiro[1,2-dihydroindene-3,4'-piperidine].

Molecular Properties

Compound Name1',6-di(propan-2-yl)spiro[1,2-dihydroindene-3,4'-piperidine]
PubChem CID170688151
Molecular FormulaC19H29N
Molecular Weight271.45 g/mol
Exact Mass271.23
IUPAC Name1',6-di(propan-2-yl)spiro[1,2-dihydroindene-3,4'-piperidine]
SMILESCC(C)c1ccc2c(c1)CCC21CCN(C(C)C)CC1
InChIInChI=1S/C19H29N/c1-14(2)16-5-6-18-17(13-16)7-8-19(18)9-11-20(12-10-19)15(3)4/h5-6,13-15H,7-12H2,1-4H3
InChIKeyABQPFGCUJNOIMS-UHFFFAOYSA-N
XLogP4.50
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.45
LogP ≤ 54.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1,1-dimethyl-2,6-di(propan-2-yl)-3,4-dihydroisoquinoline
CID 155709769
2-methyl-7-propan-2-ylspiro[1,3-dihydroisoquinoline-4,1'-cyclopropane]
CID 156637555
1-(1,1-dimethyl-6-propan-2-yl-3,4-dihydroisoquinolin-2-yl)ethanone
CID 138530645
(3R)-6-propan-2-ylspiro[1,2-dihydroindene-3,5'-pyrrolidine]-2'-one
CID 167207593
1,1-difluoro-6-propan-2-yl-3,4-dihydro-2H-isoquinoline
CID 138535856
ethane;methane;6-propan-2-yl-1,2,3,4-tetrahydronaphthalene
CID 160891896
6-bromospiro[1,2-dihydroindene-3,1'-cyclopropane];ethane
CID 145339117
1-fluoro-3-propan-2-ylbenzene;1-methyl-4-propan-2-ylpiperazine
CID 162361422
4-[[(1R,4aR,10aR)-1,4a,10a-trimethyl-7-propan-2-yl-3,4,9,10-tetrahydro-2H-phenanthren-1-yl]methyl]-1,2,4-triazolidine-3,5-dione
CID 95565744
6-(4-methyl-1-propan-2-ylpiperidin-4-yl)oxy-2,3-dihydro-1H-indole
CID 115074698
7-propan-2-yl-2-propyl-3,4-dihydro-1H-isoquinoline
CID 157149924
acetaldehyde;ethane;2-methyl-7-propan-2-yl-3,4-dihydro-1H-isoquinoline
CID 176703540

Frequently Asked Questions

What is the IUPAC name of 1',6-di(propan-2-yl)spiro[1,2-dihydroindene-3,4'-piperidine]?
The IUPAC name of 1',6-di(propan-2-yl)spiro[1,2-dihydroindene-3,4'-piperidine] (CID 170688151) is 1',6-di(propan-2-yl)spiro[1,2-dihydroindene-3,4'-piperidine].
What is the SMILES notation for 1',6-di(propan-2-yl)spiro[1,2-dihydroindene-3,4'-piperidine]?
The canonical SMILES for 1',6-di(propan-2-yl)spiro[1,2-dihydroindene-3,4'-piperidine] is CC(C)c1ccc2c(c1)CCC21CCN(C(C)C)CC1.
What is the InChIKey of 1',6-di(propan-2-yl)spiro[1,2-dihydroindene-3,4'-piperidine]?
The InChIKey is ABQPFGCUJNOIMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H29N/c1-14(2)16-5-6-18-17(13-16)7-8-19(18)9-11-20(12-10-19)15(3)4/h5-6,13-15H,7-12H2,1-4H3.
What are the key properties of 1',6-di(propan-2-yl)spiro[1,2-dihydroindene-3,4'-piperidine]?
1',6-di(propan-2-yl)spiro[1,2-dihydroindene-3,4'-piperidine] has a molecular weight of 271.45 g/mol, XLogP of 4.50, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1',6-di(propan-2-yl)spiro[1,2-dihydroindene-3,4'-piperidine] is sourced from PubChem (CID 170688151), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).