cyclopropyl-(5-methyl-1-morpholin-4-ylspiro[1,2-dihydroindene-3,4'-piperidine]-1'-yl)methanone;2,2,2-trifluoroacetic acid

C24H31F3N2O4 — CID 118742638

IUPACcyclopropyl-(5-methyl-1-morpholin-4-ylspiro[1,2-dihydroindene-3,4'-piperidine]-1'-yl)methanone;2,2,2-trifluoroacetic acid
SMILESCc1ccc2c(c1)C1(CCN(C(=O)C3CC3)CC1)CC2N1CCOCC1.O=C(O)C(F)(F)F
InChIInChI=1S/C22H30N2O2.C2HF3O2/c1-16-2-5-18-19(14-16)22(15-20(18)23-10-12-26-13-11-23)6-8-24(9-7-22)21(25)17-3-4-17;3-2(4,5)1(6)7/h2,5,14,17,20H,3-4,6-13,15H2,1H3;(H,6,7)
InChIKeyZZNGZDXKOCCYAV-UHFFFAOYSA-N
MW468.52 g/mol
LogP3.68
Rot. Bonds2

About cyclopropyl-(5-methyl-1-morpholin-4-ylspiro[1,2-dihydroindene-3,4'-piperidine]-1'-yl)methanone;2,2,2-trifluoroacetic acid

cyclopropyl-(5-methyl-1-morpholin-4-ylspiro[1,2-dihydroindene-3,4'-piperidine]-1'-yl)methanone;2,2,2-trifluoroacetic acid (PubChem CID 118742638) has the molecular formula C24H31F3N2O4 and a molecular weight of 468.52 g/mol. Its IUPAC name is cyclopropyl-(5-methyl-1-morpholin-4-ylspiro[1,2-dihydroindene-3,4'-piperidine]-1'-yl)methanone;2,2,2-trifluoroacetic acid.

Molecular Properties

Compound Namecyclopropyl-(5-methyl-1-morpholin-4-ylspiro[1,2-dihydroindene-3,4'-piperidine]-1'-yl)methanone;2,2,2-trifluoroacetic acid
PubChem CID118742638
Molecular FormulaC24H31F3N2O4
Molecular Weight468.52 g/mol
Exact Mass468.22
IUPAC Namecyclopropyl-(5-methyl-1-morpholin-4-ylspiro[1,2-dihydroindene-3,4'-piperidine]-1'-yl)methanone;2,2,2-trifluoroacetic acid
SMILESCc1ccc2c(c1)C1(CCN(C(=O)C3CC3)CC1)CC2N1CCOCC1.O=C(O)C(F)(F)F
InChIInChI=1S/C22H30N2O2.C2HF3O2/c1-16-2-5-18-19(14-16)22(15-20(18)23-10-12-26-13-11-23)6-8-24(9-7-22)21(25)17-3-4-17;3-2(4,5)1(6)7/h2,5,14,17,20H,3-4,6-13,15H2,1H3;(H,6,7)
InChIKeyZZNGZDXKOCCYAV-UHFFFAOYSA-N
XLogP3.68
TPSA70.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500468.52
LogP ≤ 53.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[1-(2-Hydroxyethyl)piperidin-4-yl]-[5-[4-(trifluoromethyl)phenyl]-9-azatricyclo[6.3.1.02,7]dodeca-2(7),3,5-trien-9-yl]methanone
CID 170341190
2-Methoxy-1-(5-methyl-1-morpholin-4-ylspiro[1,2-dihydroindene-3,4'-piperidine]-1'-yl)ethanone
CID 118738948
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
US20250387403, Example Table1.13
CID 170403626
1-(5-Methyl-1-morpholin-4-ylspiro[1,2-dihydroindene-3,4'-piperidine]-1'-yl)ethanone;2,2,2-trifluoroacetic acid
CID 118742631
1-(6-Methyl-1-morpholin-4-ylspiro[1,2-dihydroindene-3,4'-piperidine]-1'-yl)propan-1-one;2,2,2-trifluoroacetic acid
CID 118742633
1-[1-(Dimethylamino)spiro[1,2-dihydroindene-3,4'-piperidine]-1'-carbonyl]cyclopropane-1-carbonitrile;2,2,2-trifluoroacetic acid
CID 118744719
N-cyclopropyl-1-morpholin-4-ylspiro[1,2-dihydroindene-3,4'-piperidine]-1'-carboxamide;2,2,2-trifluoroacetic acid
CID 118744724
2-[1-(Dimethylamino)-6-methylspiro[1,2-dihydroindene-3,4'-piperidine]-1'-yl]ethanol;bis(2,2,2-trifluoroacetic acid)
CID 118745800
4-[1'-(2-Methoxyethyl)-6-methylspiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]morpholine;bis(2,2,2-trifluoroacetic acid)
CID 118746586

Frequently Asked Questions

What is the IUPAC name of cyclopropyl-(5-methyl-1-morpholin-4-ylspiro[1,2-dihydroindene-3,4'-piperidine]-1'-yl)methanone;2,2,2-trifluoroacetic acid?
The IUPAC name of cyclopropyl-(5-methyl-1-morpholin-4-ylspiro[1,2-dihydroindene-3,4'-piperidine]-1'-yl)methanone;2,2,2-trifluoroacetic acid (CID 118742638) is cyclopropyl-(5-methyl-1-morpholin-4-ylspiro[1,2-dihydroindene-3,4'-piperidine]-1'-yl)methanone;2,2,2-trifluoroacetic acid.
What is the SMILES notation for cyclopropyl-(5-methyl-1-morpholin-4-ylspiro[1,2-dihydroindene-3,4'-piperidine]-1'-yl)methanone;2,2,2-trifluoroacetic acid?
The canonical SMILES for cyclopropyl-(5-methyl-1-morpholin-4-ylspiro[1,2-dihydroindene-3,4'-piperidine]-1'-yl)methanone;2,2,2-trifluoroacetic acid is Cc1ccc2c(c1)C1(CCN(C(=O)C3CC3)CC1)CC2N1CCOCC1.O=C(O)C(F)(F)F.
What is the InChIKey of cyclopropyl-(5-methyl-1-morpholin-4-ylspiro[1,2-dihydroindene-3,4'-piperidine]-1'-yl)methanone;2,2,2-trifluoroacetic acid?
The InChIKey is ZZNGZDXKOCCYAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H30N2O2.C2HF3O2/c1-16-2-5-18-19(14-16)22(15-20(18)23-10-12-26-13-11-23)6-8-24(9-7-22)21(25)17-3-4-17;3-2(4,5)1(6)7/h2,5,14,17,20H,3-4,6-13,15H2,1H3;(H,6,7).
What are the key properties of cyclopropyl-(5-methyl-1-morpholin-4-ylspiro[1,2-dihydroindene-3,4'-piperidine]-1'-yl)methanone;2,2,2-trifluoroacetic acid?
cyclopropyl-(5-methyl-1-morpholin-4-ylspiro[1,2-dihydroindene-3,4'-piperidine]-1'-yl)methanone;2,2,2-trifluoroacetic acid has a molecular weight of 468.52 g/mol, XLogP of 3.68, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopropyl-(5-methyl-1-morpholin-4-ylspiro[1,2-dihydroindene-3,4'-piperidine]-1'-yl)methanone;2,2,2-trifluoroacetic acid is sourced from PubChem (CID 118742638), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).