ethane;spiro[1,3-dihydroindene-2,4'-piperidine]

C15H23N — CID 168950333

IUPACethane;spiro[1,3-dihydroindene-2,4'-piperidine]
SMILESCC.c1ccc2c(c1)CC1(CCNCC1)C2
InChIInChI=1S/C13H17N.C2H6/c1-2-4-12-10-13(9-11(12)3-1)5-7-14-8-6-13;1-2/h1-4,14H,5-10H2;1-2H3
InChIKeyLJBQBDBAZHDAQI-UHFFFAOYSA-N
MW217.36 g/mol
LogP3.18
Rot. Bonds

About ethane;spiro[1,3-dihydroindene-2,4'-piperidine]

ethane;spiro[1,3-dihydroindene-2,4'-piperidine] (PubChem CID 168950333) has the molecular formula C15H23N and a molecular weight of 217.36 g/mol. Its IUPAC name is ethane;spiro[1,3-dihydroindene-2,4'-piperidine].

Molecular Properties

Compound Nameethane;spiro[1,3-dihydroindene-2,4'-piperidine]
PubChem CID168950333
Molecular FormulaC15H23N
Molecular Weight217.36 g/mol
Exact Mass217.18
IUPAC Nameethane;spiro[1,3-dihydroindene-2,4'-piperidine]
SMILESCC.c1ccc2c(c1)CC1(CCNCC1)C2
InChIInChI=1S/C13H17N.C2H6/c1-2-4-12-10-13(9-11(12)3-1)5-7-14-8-6-13;1-2/h1-4,14H,5-10H2;1-2H3
InChIKeyLJBQBDBAZHDAQI-UHFFFAOYSA-N
XLogP3.18
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.36
LogP ≤ 53.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of ethane;spiro[1,3-dihydroindene-2,4'-piperidine]?
The IUPAC name of ethane;spiro[1,3-dihydroindene-2,4'-piperidine] (CID 168950333) is ethane;spiro[1,3-dihydroindene-2,4'-piperidine].
What is the SMILES notation for ethane;spiro[1,3-dihydroindene-2,4'-piperidine]?
The canonical SMILES for ethane;spiro[1,3-dihydroindene-2,4'-piperidine] is CC.c1ccc2c(c1)CC1(CCNCC1)C2.
What is the InChIKey of ethane;spiro[1,3-dihydroindene-2,4'-piperidine]?
The InChIKey is LJBQBDBAZHDAQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N.C2H6/c1-2-4-12-10-13(9-11(12)3-1)5-7-14-8-6-13;1-2/h1-4,14H,5-10H2;1-2H3.
What are the key properties of ethane;spiro[1,3-dihydroindene-2,4'-piperidine]?
ethane;spiro[1,3-dihydroindene-2,4'-piperidine] has a molecular weight of 217.36 g/mol, XLogP of 3.18, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;spiro[1,3-dihydroindene-2,4'-piperidine] is sourced from PubChem (CID 168950333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).