1'-[(3-morpholin-4-ylphenyl)methyl]spiro[1,2-dihydroindene-3,4'-piperidine]-2-ol

C24H30N2O2 — CID 56897611

IUPAC1'-[(3-morpholin-4-ylphenyl)methyl]spiro[1,2-dihydroindene-3,4'-piperidine]-2-ol
SMILESOC1Cc2ccccc2C12CCN(Cc1cccc(N3CCOCC3)c1)CC2
InChIInChI=1S/C24H30N2O2/c27-23-17-20-5-1-2-7-22(20)24(23)8-10-25(11-9-24)18-19-4-3-6-21(16-19)26-12-14-28-15-13-26/h1-7,16,23,27H,8-15,17-18H2
InChIKeyMGCGTZPXQDFTOG-UHFFFAOYSA-N
MW378.52 g/mol
LogP2.97
Rot. Bonds3

About 1'-[(3-morpholin-4-ylphenyl)methyl]spiro[1,2-dihydroindene-3,4'-piperidine]-2-ol

1'-[(3-morpholin-4-ylphenyl)methyl]spiro[1,2-dihydroindene-3,4'-piperidine]-2-ol (PubChem CID 56897611) has the molecular formula C24H30N2O2 and a molecular weight of 378.52 g/mol. Its IUPAC name is 1'-[(3-morpholin-4-ylphenyl)methyl]spiro[1,2-dihydroindene-3,4'-piperidine]-2-ol.

Molecular Properties

Compound Name1'-[(3-morpholin-4-ylphenyl)methyl]spiro[1,2-dihydroindene-3,4'-piperidine]-2-ol
PubChem CID56897611
Molecular FormulaC24H30N2O2
Molecular Weight378.52 g/mol
Exact Mass378.23
IUPAC Name1'-[(3-morpholin-4-ylphenyl)methyl]spiro[1,2-dihydroindene-3,4'-piperidine]-2-ol
SMILESOC1Cc2ccccc2C12CCN(Cc1cccc(N3CCOCC3)c1)CC2
InChIInChI=1S/C24H30N2O2/c27-23-17-20-5-1-2-7-22(20)24(23)8-10-25(11-9-24)18-19-4-3-6-21(16-19)26-12-14-28-15-13-26/h1-7,16,23,27H,8-15,17-18H2
InChIKeyMGCGTZPXQDFTOG-UHFFFAOYSA-N
XLogP2.97
TPSA35.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms28
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.52
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1'-[(3-morpholin-4-ylphenyl)methyl]spiro[1,2-dihydroindene-3,4'-piperidine]-2-ol?
The IUPAC name of 1'-[(3-morpholin-4-ylphenyl)methyl]spiro[1,2-dihydroindene-3,4'-piperidine]-2-ol (CID 56897611) is 1'-[(3-morpholin-4-ylphenyl)methyl]spiro[1,2-dihydroindene-3,4'-piperidine]-2-ol.
What is the SMILES notation for 1'-[(3-morpholin-4-ylphenyl)methyl]spiro[1,2-dihydroindene-3,4'-piperidine]-2-ol?
The canonical SMILES for 1'-[(3-morpholin-4-ylphenyl)methyl]spiro[1,2-dihydroindene-3,4'-piperidine]-2-ol is OC1Cc2ccccc2C12CCN(Cc1cccc(N3CCOCC3)c1)CC2.
What is the InChIKey of 1'-[(3-morpholin-4-ylphenyl)methyl]spiro[1,2-dihydroindene-3,4'-piperidine]-2-ol?
The InChIKey is MGCGTZPXQDFTOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H30N2O2/c27-23-17-20-5-1-2-7-22(20)24(23)8-10-25(11-9-24)18-19-4-3-6-21(16-19)26-12-14-28-15-13-26/h1-7,16,23,27H,8-15,17-18H2.
What are the key properties of 1'-[(3-morpholin-4-ylphenyl)methyl]spiro[1,2-dihydroindene-3,4'-piperidine]-2-ol?
1'-[(3-morpholin-4-ylphenyl)methyl]spiro[1,2-dihydroindene-3,4'-piperidine]-2-ol has a molecular weight of 378.52 g/mol, XLogP of 2.97, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1'-[(3-morpholin-4-ylphenyl)methyl]spiro[1,2-dihydroindene-3,4'-piperidine]-2-ol is sourced from PubChem (CID 56897611), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).