chlorobenzene;(3R,6'R)-6-chloro-6'-(3-fluorophenyl)spiro[1H-indole-3,5'-piperidine]-2,2'-dione

C24H19Cl2FN2O2 — CID 143538330

About chlorobenzene;(3R,6'R)-6-chloro-6'-(3-fluorophenyl)spiro[1H-indole-3,5'-piperidine]-2,2'-dione

chlorobenzene;(3R,6'R)-6-chloro-6'-(3-fluorophenyl)spiro[1H-indole-3,5'-piperidine]-2,2'-dione (PubChem CID 143538330) has the molecular formula C24H19Cl2FN2O2 and a molecular weight of 457.33 g/mol. Its IUPAC name is chlorobenzene;(3R,6'R)-6-chloro-6'-(3-fluorophenyl)spiro[1H-indole-3,5'-piperidine]-2,2'-dione.

Molecular Properties

• Compound Name: chlorobenzene;(3R,6'R)-6-chloro-6'-(3-fluorophenyl)spiro[1H-indole-3,5'-piperidine]-2,2'-dione
• PubChem CID: 143538330
• Molecular Formula: C24H19Cl2FN2O2
• Molecular Weight: 457.33 g/mol
• Exact Mass: 456.08
• IUPAC Name: chlorobenzene;(3R,6'R)-6-chloro-6'-(3-fluorophenyl)spiro[1H-indole-3,5'-piperidine]-2,2'-dione
• SMILES: Clc1ccccc1.O=C1CC[C@]2(C(=O)Nc3cc(Cl)ccc32)[C@@H](c2cccc(F)c2)N1
• InChI: InChI=1S/C18H14ClFN2O2.C6H5Cl/c19-11-4-5-13-14(9-11)21-17(24)18(13)7-6-15(23)22-16(18)10-2-1-3-12(20)8-10;7-6-4-2-1-3-5-6/h1-5,8-9,16H,6-7H2,(H,21,24)(H,22,23);1-5H/t16-,18-;/m1./s1
• InChIKey: QJWSFTNCCCWPOM-PHJLCXHGSA-N
• XLogP: 5.66
• TPSA: 58.20 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 2
• Rotatable Bonds: 1
• Heavy Atoms: 31
• Complexity: —

Lipinski Rule of Five

1 violation

Rule	Value
MW ≤ 500	457.33
LogP ≤ 5	5.66
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	2

Frequently Asked Questions

What is the IUPAC name of chlorobenzene;(3R,6'R)-6-chloro-6'-(3-fluorophenyl)spiro[1H-indole-3,5'-piperidine]-2,2'-dione?

The IUPAC name of chlorobenzene;(3R,6'R)-6-chloro-6'-(3-fluorophenyl)spiro[1H-indole-3,5'-piperidine]-2,2'-dione (CID 143538330) is chlorobenzene;(3R,6'R)-6-chloro-6'-(3-fluorophenyl)spiro[1H-indole-3,5'-piperidine]-2,2'-dione.

What is the SMILES notation for chlorobenzene;(3R,6'R)-6-chloro-6'-(3-fluorophenyl)spiro[1H-indole-3,5'-piperidine]-2,2'-dione?

The canonical SMILES for chlorobenzene;(3R,6'R)-6-chloro-6'-(3-fluorophenyl)spiro[1H-indole-3,5'-piperidine]-2,2'-dione is Clc1ccccc1.O=C1CC[C@]2(C(=O)Nc3cc(Cl)ccc32)[C@@H](c2cccc(F)c2)N1.

What is the InChIKey of chlorobenzene;(3R,6'R)-6-chloro-6'-(3-fluorophenyl)spiro[1H-indole-3,5'-piperidine]-2,2'-dione?

The InChIKey is QJWSFTNCCCWPOM-PHJLCXHGSA-N. The full InChI is InChI=1S/C18H14ClFN2O2.C6H5Cl/c19-11-4-5-13-14(9-11)21-17(24)18(13)7-6-15(23)22-16(18)10-2-1-3-12(20)8-10;7-6-4-2-1-3-5-6/h1-5,8-9,16H,6-7H2,(H,21,24)(H,22,23);1-5H/t16-,18-;/m1./s1.

What are the key properties of chlorobenzene;(3R,6'R)-6-chloro-6'-(3-fluorophenyl)spiro[1H-indole-3,5'-piperidine]-2,2'-dione?

chlorobenzene;(3R,6'R)-6-chloro-6'-(3-fluorophenyl)spiro[1H-indole-3,5'-piperidine]-2,2'-dione has a molecular weight of 457.33 g/mol, XLogP of 5.66, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.

Where does this data come from?

All data for chlorobenzene;(3R,6'R)-6-chloro-6'-(3-fluorophenyl)spiro[1H-indole-3,5'-piperidine]-2,2'-dione is sourced from PubChem (CID 143538330), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).