2-morpholin-3-yl-1-spiro[1,2-dihydroindene-3,4'-piperidine]-1'-ylethanone

C19H26N2O2 — CID 56881531

IUPAC2-morpholin-3-yl-1-spiro[1,2-dihydroindene-3,4'-piperidine]-1'-ylethanone
SMILESO=C(CC1COCCN1)N1CCC2(CCc3ccccc32)CC1
InChIInChI=1S/C19H26N2O2/c22-18(13-16-14-23-12-9-20-16)21-10-7-19(8-11-21)6-5-15-3-1-2-4-17(15)19/h1-4,16,20H,5-14H2
InChIKeyWPWJOULTXLBCLD-UHFFFAOYSA-N
MW314.43 g/mol
LogP1.87
Rot. Bonds2

About 2-morpholin-3-yl-1-spiro[1,2-dihydroindene-3,4'-piperidine]-1'-ylethanone

2-morpholin-3-yl-1-spiro[1,2-dihydroindene-3,4'-piperidine]-1'-ylethanone (PubChem CID 56881531) has the molecular formula C19H26N2O2 and a molecular weight of 314.43 g/mol. Its IUPAC name is 2-morpholin-3-yl-1-spiro[1,2-dihydroindene-3,4'-piperidine]-1'-ylethanone.

Molecular Properties

Compound Name2-morpholin-3-yl-1-spiro[1,2-dihydroindene-3,4'-piperidine]-1'-ylethanone
PubChem CID56881531
Molecular FormulaC19H26N2O2
Molecular Weight314.43 g/mol
Exact Mass314.20
IUPAC Name2-morpholin-3-yl-1-spiro[1,2-dihydroindene-3,4'-piperidine]-1'-ylethanone
SMILESO=C(CC1COCCN1)N1CCC2(CCc3ccccc32)CC1
InChIInChI=1S/C19H26N2O2/c22-18(13-16-14-23-12-9-20-16)21-10-7-19(8-11-21)6-5-15-3-1-2-4-17(15)19/h1-4,16,20H,5-14H2
InChIKeyWPWJOULTXLBCLD-UHFFFAOYSA-N
XLogP1.87
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.43
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-morpholin-3-yl-1-spiro[1,2-dihydroindene-3,4'-piperidine]-1'-ylethanone?
The IUPAC name of 2-morpholin-3-yl-1-spiro[1,2-dihydroindene-3,4'-piperidine]-1'-ylethanone (CID 56881531) is 2-morpholin-3-yl-1-spiro[1,2-dihydroindene-3,4'-piperidine]-1'-ylethanone.
What is the SMILES notation for 2-morpholin-3-yl-1-spiro[1,2-dihydroindene-3,4'-piperidine]-1'-ylethanone?
The canonical SMILES for 2-morpholin-3-yl-1-spiro[1,2-dihydroindene-3,4'-piperidine]-1'-ylethanone is O=C(CC1COCCN1)N1CCC2(CCc3ccccc32)CC1.
What is the InChIKey of 2-morpholin-3-yl-1-spiro[1,2-dihydroindene-3,4'-piperidine]-1'-ylethanone?
The InChIKey is WPWJOULTXLBCLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N2O2/c22-18(13-16-14-23-12-9-20-16)21-10-7-19(8-11-21)6-5-15-3-1-2-4-17(15)19/h1-4,16,20H,5-14H2.
What are the key properties of 2-morpholin-3-yl-1-spiro[1,2-dihydroindene-3,4'-piperidine]-1'-ylethanone?
2-morpholin-3-yl-1-spiro[1,2-dihydroindene-3,4'-piperidine]-1'-ylethanone has a molecular weight of 314.43 g/mol, XLogP of 1.87, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-morpholin-3-yl-1-spiro[1,2-dihydroindene-3,4'-piperidine]-1'-ylethanone is sourced from PubChem (CID 56881531), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).