3,4-dihydro-2H-quinolin-1-yl(spiro[1,2-dihydroindene-3,4'-piperidine]-2-yl)methanone

C23H26N2O — CID 91338834

IUPAC3,4-dihydro-2H-quinolin-1-yl(spiro[1,2-dihydroindene-3,4'-piperidine]-2-yl)methanone
SMILESO=C(C1Cc2ccccc2C12CCNCC2)N1CCCc2ccccc21
InChIInChI=1S/C23H26N2O/c26-22(25-15-5-8-17-6-2-4-10-21(17)25)20-16-18-7-1-3-9-19(18)23(20)11-13-24-14-12-23/h1-4,6-7,9-10,20,24H,5,8,11-16H2
InChIKeyJPOAENILVAGXKQ-UHFFFAOYSA-N
MW346.47 g/mol
LogP3.46
Rot. Bonds1

About 3,4-dihydro-2H-quinolin-1-yl(spiro[1,2-dihydroindene-3,4'-piperidine]-2-yl)methanone

3,4-dihydro-2H-quinolin-1-yl(spiro[1,2-dihydroindene-3,4'-piperidine]-2-yl)methanone (PubChem CID 91338834) has the molecular formula C23H26N2O and a molecular weight of 346.47 g/mol. Its IUPAC name is 3,4-dihydro-2H-quinolin-1-yl(spiro[1,2-dihydroindene-3,4'-piperidine]-2-yl)methanone.

Molecular Properties

Compound Name3,4-dihydro-2H-quinolin-1-yl(spiro[1,2-dihydroindene-3,4'-piperidine]-2-yl)methanone
PubChem CID91338834
Molecular FormulaC23H26N2O
Molecular Weight346.47 g/mol
Exact Mass346.20
IUPAC Name3,4-dihydro-2H-quinolin-1-yl(spiro[1,2-dihydroindene-3,4'-piperidine]-2-yl)methanone
SMILESO=C(C1Cc2ccccc2C12CCNCC2)N1CCCc2ccccc21
InChIInChI=1S/C23H26N2O/c26-22(25-15-5-8-17-6-2-4-10-21(17)25)20-16-18-7-1-3-9-19(18)23(20)11-13-24-14-12-23/h1-4,6-7,9-10,20,24H,5,8,11-16H2
InChIKeyJPOAENILVAGXKQ-UHFFFAOYSA-N
XLogP3.46
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.47
LogP ≤ 53.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3,4-dihydro-2H-quinolin-1-yl(spiro[1,2-dihydroindene-3,4'-piperidine]-2-yl)methanone?
The IUPAC name of 3,4-dihydro-2H-quinolin-1-yl(spiro[1,2-dihydroindene-3,4'-piperidine]-2-yl)methanone (CID 91338834) is 3,4-dihydro-2H-quinolin-1-yl(spiro[1,2-dihydroindene-3,4'-piperidine]-2-yl)methanone.
What is the SMILES notation for 3,4-dihydro-2H-quinolin-1-yl(spiro[1,2-dihydroindene-3,4'-piperidine]-2-yl)methanone?
The canonical SMILES for 3,4-dihydro-2H-quinolin-1-yl(spiro[1,2-dihydroindene-3,4'-piperidine]-2-yl)methanone is O=C(C1Cc2ccccc2C12CCNCC2)N1CCCc2ccccc21.
What is the InChIKey of 3,4-dihydro-2H-quinolin-1-yl(spiro[1,2-dihydroindene-3,4'-piperidine]-2-yl)methanone?
The InChIKey is JPOAENILVAGXKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H26N2O/c26-22(25-15-5-8-17-6-2-4-10-21(17)25)20-16-18-7-1-3-9-19(18)23(20)11-13-24-14-12-23/h1-4,6-7,9-10,20,24H,5,8,11-16H2.
What are the key properties of 3,4-dihydro-2H-quinolin-1-yl(spiro[1,2-dihydroindene-3,4'-piperidine]-2-yl)methanone?
3,4-dihydro-2H-quinolin-1-yl(spiro[1,2-dihydroindene-3,4'-piperidine]-2-yl)methanone has a molecular weight of 346.47 g/mol, XLogP of 3.46, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-dihydro-2H-quinolin-1-yl(spiro[1,2-dihydroindene-3,4'-piperidine]-2-yl)methanone is sourced from PubChem (CID 91338834), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).