5-propan-2-yl-1'-prop-2-enylspiro[1,2-dihydroindole-3,4'-piperidine]

C18H26N2 — CID 143074032

IUPAC5-propan-2-yl-1'-prop-2-enylspiro[1,2-dihydroindole-3,4'-piperidine]
SMILESC=CCN1CCC2(CC1)CNc1ccc(C(C)C)cc12
InChIInChI=1S/C18H26N2/c1-4-9-20-10-7-18(8-11-20)13-19-17-6-5-15(14(2)3)12-16(17)18/h4-6,12,14,19H,1,7-11,13H2,2-3H3
InChIKeyUFLNYGDNHGYWCQ-UHFFFAOYSA-N
MW270.42 g/mol
LogP3.76
Rot. Bonds3

About 5-propan-2-yl-1'-prop-2-enylspiro[1,2-dihydroindole-3,4'-piperidine]

5-propan-2-yl-1'-prop-2-enylspiro[1,2-dihydroindole-3,4'-piperidine] (PubChem CID 143074032) has the molecular formula C18H26N2 and a molecular weight of 270.42 g/mol. Its IUPAC name is 5-propan-2-yl-1'-prop-2-enylspiro[1,2-dihydroindole-3,4'-piperidine].

Molecular Properties

Compound Name5-propan-2-yl-1'-prop-2-enylspiro[1,2-dihydroindole-3,4'-piperidine]
PubChem CID143074032
Molecular FormulaC18H26N2
Molecular Weight270.42 g/mol
Exact Mass270.21
IUPAC Name5-propan-2-yl-1'-prop-2-enylspiro[1,2-dihydroindole-3,4'-piperidine]
SMILESC=CCN1CCC2(CC1)CNc1ccc(C(C)C)cc12
InChIInChI=1S/C18H26N2/c1-4-9-20-10-7-18(8-11-20)13-19-17-6-5-15(14(2)3)12-16(17)18/h4-6,12,14,19H,1,7-11,13H2,2-3H3
InChIKeyUFLNYGDNHGYWCQ-UHFFFAOYSA-N
XLogP3.76
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.42
LogP ≤ 53.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

1'-(1-cyclopentylethyl)-5-methylspiro[1,2-dihydroindole-3,4'-piperidine]
CID 70957715
1'-[(1R)-1-cyclopentylethyl]-5-methylspiro[1,2-dihydroindole-3,4'-piperidine]
CID 70957527
5-fluoro-1'-[(2R)-2-[(2R)-oxolan-2-yl]propyl]spiro[1,2-dihydroindole-3,4'-piperidine];molecular hydrogen
CID 161412318
2,7-di(propan-2-yl)-9,9-bis(prop-2-enyl)fluorene
CID 178181307
4',4'-difluoro-5-methoxyspiro[1,2-dihydroindole-3,1'-cyclohexane]
CID 106701810
1'-(3-bicyclo[3.2.1]octanyl)-5-methylspiro[1,2-dihydroindole-3,4'-piperidine]
CID 59433436
(3R)-5-chloro-1'-methylspiro[1,2-dihydroindole-3,3'-pyrrolidine]
CID 70993859
1',6-di(propan-2-yl)spiro[1,2-dihydroindene-3,4'-piperidine]
CID 170688151
5-propan-2-ylspiro[1H-indole-3,1'-cyclohexane]-2-one
CID 82085220
1-(5-methoxy-1'-prop-2-enylspiro[2H-indole-3,4'-piperidine]-1-yl)-3-methylbutan-1-one
CID 23991716
[1'-(methylsulfonylmethylsulfonyl)spiro[1,2-dihydroindole-3,4'-piperidine]-5-yl]methanamine
CID 91141346
2-(4-propan-2-yloxyphenyl)-2-(4-prop-2-enylpiperazin-1-yl)acetic acid
CID 46986932

Frequently Asked Questions

What is the IUPAC name of 5-propan-2-yl-1'-prop-2-enylspiro[1,2-dihydroindole-3,4'-piperidine]?
The IUPAC name of 5-propan-2-yl-1'-prop-2-enylspiro[1,2-dihydroindole-3,4'-piperidine] (CID 143074032) is 5-propan-2-yl-1'-prop-2-enylspiro[1,2-dihydroindole-3,4'-piperidine].
What is the SMILES notation for 5-propan-2-yl-1'-prop-2-enylspiro[1,2-dihydroindole-3,4'-piperidine]?
The canonical SMILES for 5-propan-2-yl-1'-prop-2-enylspiro[1,2-dihydroindole-3,4'-piperidine] is C=CCN1CCC2(CC1)CNc1ccc(C(C)C)cc12.
What is the InChIKey of 5-propan-2-yl-1'-prop-2-enylspiro[1,2-dihydroindole-3,4'-piperidine]?
The InChIKey is UFLNYGDNHGYWCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N2/c1-4-9-20-10-7-18(8-11-20)13-19-17-6-5-15(14(2)3)12-16(17)18/h4-6,12,14,19H,1,7-11,13H2,2-3H3.
What are the key properties of 5-propan-2-yl-1'-prop-2-enylspiro[1,2-dihydroindole-3,4'-piperidine]?
5-propan-2-yl-1'-prop-2-enylspiro[1,2-dihydroindole-3,4'-piperidine] has a molecular weight of 270.42 g/mol, XLogP of 3.76, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-propan-2-yl-1'-prop-2-enylspiro[1,2-dihydroindole-3,4'-piperidine] is sourced from PubChem (CID 143074032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).