1'-(4-chlorophenyl)-2'-(2-oxo-1,3-dihydroindol-3-yl)spiro[1H-indole-3,5'-pyrrolidine]-2,3'-dione

C25H18ClN3O3 — CID 102590867

IUPAC1'-(4-chlorophenyl)-2'-(2-oxo-1,3-dihydroindol-3-yl)spiro[1H-indole-3,5'-pyrrolidine]-2,3'-dione
SMILESO=C1Nc2ccccc2C1C1C(=O)CC2(C(=O)Nc3ccccc32)N1c1ccc(Cl)cc1
InChIInChI=1S/C25H18ClN3O3/c26-14-9-11-15(12-10-14)29-22(21-16-5-1-3-7-18(16)27-23(21)31)20(30)13-25(29)17-6-2-4-8-19(17)28-24(25)32/h1-12,21-22H,13H2,(H,27,31)(H,28,32)
InChIKeyWXVOXGMNNZFHBL-UHFFFAOYSA-N
MW443.89 g/mol
LogP4.07
Rot. Bonds2

About 1'-(4-chlorophenyl)-2'-(2-oxo-1,3-dihydroindol-3-yl)spiro[1H-indole-3,5'-pyrrolidine]-2,3'-dione

1'-(4-chlorophenyl)-2'-(2-oxo-1,3-dihydroindol-3-yl)spiro[1H-indole-3,5'-pyrrolidine]-2,3'-dione (PubChem CID 102590867) has the molecular formula C25H18ClN3O3 and a molecular weight of 443.89 g/mol. Its IUPAC name is 1'-(4-chlorophenyl)-2'-(2-oxo-1,3-dihydroindol-3-yl)spiro[1H-indole-3,5'-pyrrolidine]-2,3'-dione.

Molecular Properties

Compound Name1'-(4-chlorophenyl)-2'-(2-oxo-1,3-dihydroindol-3-yl)spiro[1H-indole-3,5'-pyrrolidine]-2,3'-dione
PubChem CID102590867
Molecular FormulaC25H18ClN3O3
Molecular Weight443.89 g/mol
Exact Mass443.10
IUPAC Name1'-(4-chlorophenyl)-2'-(2-oxo-1,3-dihydroindol-3-yl)spiro[1H-indole-3,5'-pyrrolidine]-2,3'-dione
SMILESO=C1Nc2ccccc2C1C1C(=O)CC2(C(=O)Nc3ccccc32)N1c1ccc(Cl)cc1
InChIInChI=1S/C25H18ClN3O3/c26-14-9-11-15(12-10-14)29-22(21-16-5-1-3-7-18(16)27-23(21)31)20(30)13-25(29)17-6-2-4-8-19(17)28-24(25)32/h1-12,21-22H,13H2,(H,27,31)(H,28,32)
InChIKeyWXVOXGMNNZFHBL-UHFFFAOYSA-N
XLogP4.07
TPSA78.51 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500443.89
LogP ≤ 54.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(1S,2S)-1-hydroxyspiro[1,3-dihydroindene-2,3'-1H-indole]-2'-one
CID 134951476
4-[(3S)-3'-(4-chlorophenyl)-2-oxospiro[1H-indole-3,5'-4H-pyrazole]-1'-yl]-4-oxobutanoic acid
CID 41009654
1'-(4-chlorophenyl)spiro[1,2-dihydroindene-3,5'-imidazolidine]-2',4'-dione
CID 141235687
1'-(4-chlorobenzoyl)spiro[1H-indole-3,4'-piperidine]-2-one
CID 56892371
1'-(4-chlorophenyl)-6'-(4-chlorophenyl)imino-2,2'-dioxospiro[1H-indole-3,4'-piperidine]-3'-carbonitrile
CID 15366589
(3'aS,8'aS,8'bR)-2'-(4-chlorophenyl)spiro[1H-indole-3,4'-3a,6,7,8,8a,8b-hexahydropyrrolo[3,4-a]pyrrolizine]-1',2,3'-trione
CID 10894816
(2'S,3S,3'R,10'bR)-2',3'-bis(4-chlorobenzoyl)spiro[1H-indole-3,1'-3,10b-dihydro-2H-pyrrolo[2,1-a]isoquinoline]-2-one
CID 98454374
N-(4-chlorophenyl)-2-oxo-2-[(3R)-2-oxo-1,3-dihydroindol-3-yl]acetamide
CID 2272538
3-[1-(4-chlorophenyl)tetrazol-5-yl]sulfanyl-1,3,4,5-tetrahydro-1-benzazepin-2-one
CID 42651827
4-chloro-6,10b-dihydro-4aH-benzo[c][2,7]naphthyridin-5-one
CID 10537564
(2'R,3R,3'S,10'bR)-3'-(2-chlorobenzoyl)-2'-(4-chlorobenzoyl)spiro[1H-indole-3,1'-3,10b-dihydro-2H-pyrrolo[2,1-a]isoquinoline]-2-one
CID 100847075
4'-(4-Chlorobenzoyl)-1'-methyl-dispiro[indole-3(2H),2'-pyrrolidine-3',3''(2''H)-indole]-2,2''-dione
CID 139068687

Frequently Asked Questions

What is the IUPAC name of 1'-(4-chlorophenyl)-2'-(2-oxo-1,3-dihydroindol-3-yl)spiro[1H-indole-3,5'-pyrrolidine]-2,3'-dione?
The IUPAC name of 1'-(4-chlorophenyl)-2'-(2-oxo-1,3-dihydroindol-3-yl)spiro[1H-indole-3,5'-pyrrolidine]-2,3'-dione (CID 102590867) is 1'-(4-chlorophenyl)-2'-(2-oxo-1,3-dihydroindol-3-yl)spiro[1H-indole-3,5'-pyrrolidine]-2,3'-dione.
What is the SMILES notation for 1'-(4-chlorophenyl)-2'-(2-oxo-1,3-dihydroindol-3-yl)spiro[1H-indole-3,5'-pyrrolidine]-2,3'-dione?
The canonical SMILES for 1'-(4-chlorophenyl)-2'-(2-oxo-1,3-dihydroindol-3-yl)spiro[1H-indole-3,5'-pyrrolidine]-2,3'-dione is O=C1Nc2ccccc2C1C1C(=O)CC2(C(=O)Nc3ccccc32)N1c1ccc(Cl)cc1.
What is the InChIKey of 1'-(4-chlorophenyl)-2'-(2-oxo-1,3-dihydroindol-3-yl)spiro[1H-indole-3,5'-pyrrolidine]-2,3'-dione?
The InChIKey is WXVOXGMNNZFHBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H18ClN3O3/c26-14-9-11-15(12-10-14)29-22(21-16-5-1-3-7-18(16)27-23(21)31)20(30)13-25(29)17-6-2-4-8-19(17)28-24(25)32/h1-12,21-22H,13H2,(H,27,31)(H,28,32).
What are the key properties of 1'-(4-chlorophenyl)-2'-(2-oxo-1,3-dihydroindol-3-yl)spiro[1H-indole-3,5'-pyrrolidine]-2,3'-dione?
1'-(4-chlorophenyl)-2'-(2-oxo-1,3-dihydroindol-3-yl)spiro[1H-indole-3,5'-pyrrolidine]-2,3'-dione has a molecular weight of 443.89 g/mol, XLogP of 4.07, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1'-(4-chlorophenyl)-2'-(2-oxo-1,3-dihydroindol-3-yl)spiro[1H-indole-3,5'-pyrrolidine]-2,3'-dione is sourced from PubChem (CID 102590867), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).