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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Related Compounds

3'-(2-methylpropyl)spiro[2,4-dihydro-1H-naphthalene-3,4'-piperidine]
CID 79321001
2-benzyl-6-propyl-2,8-diazaspiro[4.5]decane
CID 79321591
3'-(4-methylphenyl)spiro[1,3-dihydroindene-2,4'-piperidine]
CID 79432560
6-propyl-2-oxa-8-azaspiro[4.5]decane
CID 79321500
3'-(4-bromophenyl)spiro[1,3-dihydroindene-2,4'-piperidine]
CID 79433874
3'-(3-methylphenyl)spiro[1,3-dihydroindene-2,4'-piperidine]
CID 79432318
8-methyl-3'-propylspiro[8-azabicyclo[3.2.1]octane-3,4'-piperidine]
CID 79321115
4-fluoro-4-methyl-3-propylpiperidine
CID 84716694
9-propan-2-yl-5-propyl-3-azaspiro[5.6]dodecane
CID 79321593
11-propyl-2λ6-thia-9-azaspiro[5.5]undecane 2,2-dioxide
CID 79320236
(1S)-spiro[1,3-dihydroindene-2,4'-piperidine]-1-amine
CID 139512047
ethane;spiro[1,3-dihydroindene-2,4'-piperidine]
CID 168950333

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).