4-[1'-(2-methoxyethyl)-6-methylspiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]morpholine

C21H32N2O2 — CID 118746587

IUPAC4-[1'-(2-methoxyethyl)-6-methylspiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]morpholine
SMILESCOCCN1CCC2(CC1)CC(N1CCOCC1)c1cc(C)ccc12
InChIInChI=1S/C21H32N2O2/c1-17-3-4-19-18(15-17)20(23-10-13-25-14-11-23)16-21(19)5-7-22(8-6-21)9-12-24-2/h3-4,15,20H,5-14,16H2,1-2H3
InChIKeyAMBDXJMHGMOLNZ-UHFFFAOYSA-N
MW344.50 g/mol
LogP2.75
Rot. Bonds4

About 4-[1'-(2-methoxyethyl)-6-methylspiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]morpholine

4-[1'-(2-methoxyethyl)-6-methylspiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]morpholine (PubChem CID 118746587) has the molecular formula C21H32N2O2 and a molecular weight of 344.50 g/mol. Its IUPAC name is 4-[1'-(2-methoxyethyl)-6-methylspiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]morpholine.

Molecular Properties

Compound Name4-[1'-(2-methoxyethyl)-6-methylspiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]morpholine
PubChem CID118746587
Molecular FormulaC21H32N2O2
Molecular Weight344.50 g/mol
Exact Mass344.25
IUPAC Name4-[1'-(2-methoxyethyl)-6-methylspiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]morpholine
SMILESCOCCN1CCC2(CC1)CC(N1CCOCC1)c1cc(C)ccc12
InChIInChI=1S/C21H32N2O2/c1-17-3-4-19-18(15-17)20(23-10-13-25-14-11-23)16-21(19)5-7-22(8-6-21)9-12-24-2/h3-4,15,20H,5-14,16H2,1-2H3
InChIKeyAMBDXJMHGMOLNZ-UHFFFAOYSA-N
XLogP2.75
TPSA24.94 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.50
LogP ≤ 52.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

4-[[2-(3,5-Dimethylphenyl)-5-(2-methyloctan-2-yl)phenyl]methyl]morpholine
CID 44432004
4-(9H-fluoren-9-yl)morpholine
CID 224093
4-(9H-fluoren-2-ylmethyl)morpholine
CID 418224
4-(6-Methyl-2,3-dihydrospiro[indene-1,4'-piperidine]-3-yl)morpholine
CID 118738943
2-Methoxy-1-(5-methyl-1-morpholin-4-ylspiro[1,2-dihydroindene-3,4'-piperidine]-1'-yl)ethanone
CID 118738948
4-(5-Methyl-2,3-dihydrospiro[indene-1,4'-piperidin]-3-yl)morpholine
CID 118740840
2-[(5-Methylspiro[1,2-dihydroindene-3,4'-piperidine]-1-yl)amino]ethanol
CID 118742134
1-(5-Methyl-1-morpholin-4-ylspiro[1,2-dihydroindene-3,4'-piperidine]-1'-yl)ethanone
CID 118742632
1-(6-Methyl-1-morpholin-4-ylspiro[1,2-dihydroindene-3,4'-piperidine]-1'-yl)propan-1-one
CID 118742634
Cyclopropyl-(5-methyl-1-morpholin-4-ylspiro[1,2-dihydroindene-3,4'-piperidine]-1'-yl)methanone
CID 118742639
2-[1-(Dimethylamino)-6-methylspiro[1,2-dihydroindene-3,4'-piperidine]-1'-yl]ethanol
CID 118745801
4-[1'-(2-Methoxyethyl)-5-methylspiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]morpholine
CID 118746589

Frequently Asked Questions

What is the IUPAC name of 4-[1'-(2-methoxyethyl)-6-methylspiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]morpholine?
The IUPAC name of 4-[1'-(2-methoxyethyl)-6-methylspiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]morpholine (CID 118746587) is 4-[1'-(2-methoxyethyl)-6-methylspiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]morpholine.
What is the SMILES notation for 4-[1'-(2-methoxyethyl)-6-methylspiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]morpholine?
The canonical SMILES for 4-[1'-(2-methoxyethyl)-6-methylspiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]morpholine is COCCN1CCC2(CC1)CC(N1CCOCC1)c1cc(C)ccc12.
What is the InChIKey of 4-[1'-(2-methoxyethyl)-6-methylspiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]morpholine?
The InChIKey is AMBDXJMHGMOLNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H32N2O2/c1-17-3-4-19-18(15-17)20(23-10-13-25-14-11-23)16-21(19)5-7-22(8-6-21)9-12-24-2/h3-4,15,20H,5-14,16H2,1-2H3.
What are the key properties of 4-[1'-(2-methoxyethyl)-6-methylspiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]morpholine?
4-[1'-(2-methoxyethyl)-6-methylspiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]morpholine has a molecular weight of 344.50 g/mol, XLogP of 2.75, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[1'-(2-methoxyethyl)-6-methylspiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]morpholine is sourced from PubChem (CID 118746587), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).