3'-propylspiro[1,3-dihydroindene-2,4'-piperidine]

C16H23N — CID 79320324

IUPAC3'-propylspiro[1,3-dihydroindene-2,4'-piperidine]
SMILESCCCC1CNCCC12Cc1ccccc1C2
InChIInChI=1S/C16H23N/c1-2-5-15-12-17-9-8-16(15)10-13-6-3-4-7-14(13)11-16/h3-4,6-7,15,17H,2,5,8-12H2,1H3
InChIKeyMDEBKIOQTKUEOA-UHFFFAOYSA-N
MW229.37 g/mol
LogP3.18
Rot. Bonds2

About 3'-propylspiro[1,3-dihydroindene-2,4'-piperidine]

3'-propylspiro[1,3-dihydroindene-2,4'-piperidine] (PubChem CID 79320324) has the molecular formula C16H23N and a molecular weight of 229.37 g/mol. Its IUPAC name is 3'-propylspiro[1,3-dihydroindene-2,4'-piperidine].

Molecular Properties

Compound Name3'-propylspiro[1,3-dihydroindene-2,4'-piperidine]
PubChem CID79320324
Molecular FormulaC16H23N
Molecular Weight229.37 g/mol
Exact Mass229.18
IUPAC Name3'-propylspiro[1,3-dihydroindene-2,4'-piperidine]
SMILESCCCC1CNCCC12Cc1ccccc1C2
InChIInChI=1S/C16H23N/c1-2-5-15-12-17-9-8-16(15)10-13-6-3-4-7-14(13)11-16/h3-4,6-7,15,17H,2,5,8-12H2,1H3
InChIKeyMDEBKIOQTKUEOA-UHFFFAOYSA-N
XLogP3.18
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.37
LogP ≤ 53.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3'-propylspiro[1,3-dihydroindene-2,4'-piperidine]?
The IUPAC name of 3'-propylspiro[1,3-dihydroindene-2,4'-piperidine] (CID 79320324) is 3'-propylspiro[1,3-dihydroindene-2,4'-piperidine].
What is the SMILES notation for 3'-propylspiro[1,3-dihydroindene-2,4'-piperidine]?
The canonical SMILES for 3'-propylspiro[1,3-dihydroindene-2,4'-piperidine] is CCCC1CNCCC12Cc1ccccc1C2.
What is the InChIKey of 3'-propylspiro[1,3-dihydroindene-2,4'-piperidine]?
The InChIKey is MDEBKIOQTKUEOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N/c1-2-5-15-12-17-9-8-16(15)10-13-6-3-4-7-14(13)11-16/h3-4,6-7,15,17H,2,5,8-12H2,1H3.
What are the key properties of 3'-propylspiro[1,3-dihydroindene-2,4'-piperidine]?
3'-propylspiro[1,3-dihydroindene-2,4'-piperidine] has a molecular weight of 229.37 g/mol, XLogP of 3.18, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3'-propylspiro[1,3-dihydroindene-2,4'-piperidine] is sourced from PubChem (CID 79320324), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).