1'-(4-chlorobenzoyl)-1-(2-phenylethyl)spiro[indole-3,3'-pyrrolidine]-2-one

C26H23ClN2O2 — CID 134788843

IUPAC1'-(4-chlorobenzoyl)-1-(2-phenylethyl)spiro[indole-3,3'-pyrrolidine]-2-one
SMILESO=C(c1ccc(Cl)cc1)N1CCC2(C1)C(=O)N(CCc1ccccc1)c1ccccc12
InChIInChI=1S/C26H23ClN2O2/c27-21-12-10-20(11-13-21)24(30)28-17-15-26(18-28)22-8-4-5-9-23(22)29(25(26)31)16-14-19-6-2-1-3-7-19/h1-13H,14-18H2
InChIKeyFNOGTHKBZGORSF-UHFFFAOYSA-N
MW430.94 g/mol
LogP4.71
Rot. Bonds4

About 1'-(4-chlorobenzoyl)-1-(2-phenylethyl)spiro[indole-3,3'-pyrrolidine]-2-one

1'-(4-chlorobenzoyl)-1-(2-phenylethyl)spiro[indole-3,3'-pyrrolidine]-2-one (PubChem CID 134788843) has the molecular formula C26H23ClN2O2 and a molecular weight of 430.94 g/mol. Its IUPAC name is 1'-(4-chlorobenzoyl)-1-(2-phenylethyl)spiro[indole-3,3'-pyrrolidine]-2-one.

Molecular Properties

Compound Name1'-(4-chlorobenzoyl)-1-(2-phenylethyl)spiro[indole-3,3'-pyrrolidine]-2-one
PubChem CID134788843
Molecular FormulaC26H23ClN2O2
Molecular Weight430.94 g/mol
Exact Mass430.14
IUPAC Name1'-(4-chlorobenzoyl)-1-(2-phenylethyl)spiro[indole-3,3'-pyrrolidine]-2-one
SMILESO=C(c1ccc(Cl)cc1)N1CCC2(C1)C(=O)N(CCc1ccccc1)c1ccccc12
InChIInChI=1S/C26H23ClN2O2/c27-21-12-10-20(11-13-21)24(30)28-17-15-26(18-28)22-8-4-5-9-23(22)29(25(26)31)16-14-19-6-2-1-3-7-19/h1-13H,14-18H2
InChIKeyFNOGTHKBZGORSF-UHFFFAOYSA-N
XLogP4.71
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500430.94
LogP ≤ 54.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

methyl 2-oxo-1-(2-phenylethyl)spiro[indole-3,3'-pyrrolidine]-1'-carboxylate
CID 134795039
1'-[2-(4-fluorophenyl)acetyl]-1-(2-phenylethyl)spiro[indole-3,3'-pyrrolidine]-2-one
CID 134795624
3-[2-(4-chlorophenyl)-2-oxoethyl]-3-hydroxy-1-(2-phenylethyl)indol-2-one
CID 2909994
(3R)-1-methyl-1'-(4-methylbenzoyl)spiro[indole-3,3'-pyrrolidine]-2-one
CID 95103905
(3S)-1'-(4-fluorobenzoyl)-1-methylspiro[indole-3,3'-pyrrolidine]-2-one
CID 95103940
2-[1'-(3,4-dimethylbenzoyl)-2-oxospiro[indole-3,3'-pyrrolidine]-1-yl]acetamide
CID 70723838
1'-(4-chlorobenzoyl)spiro[1H-indole-3,4'-piperidine]-2-one
CID 56892371
1-(2-methoxyethyl)-1'-[6-(1,2,4-triazol-4-yl)pyridine-2-carbonyl]spiro[indole-3,3'-pyrrolidine]-2-one
CID 157018402
2-[(3R)-1'-(2-methylbenzoyl)-2-oxospiro[indole-3,3'-pyrrolidine]-1-yl]acetamide
CID 96581096
1-(cyclopropylmethyl)-1'-(1-oxo-2,3-dihydroindene-4-carbonyl)spiro[indole-3,3'-pyrrolidine]-2-one
CID 157014311
1-[(3-methoxyphenyl)methyl]-1'-(1H-pyrrole-2-carbonyl)spiro[indole-3,3'-pyrrolidine]-2-one
CID 157015900
1-(3-methylbutyl)-1'-(1-methylimidazole-4-carbonyl)spiro[indole-3,3'-pyrrolidine]-2-one
CID 157018992

Frequently Asked Questions

What is the IUPAC name of 1'-(4-chlorobenzoyl)-1-(2-phenylethyl)spiro[indole-3,3'-pyrrolidine]-2-one?
The IUPAC name of 1'-(4-chlorobenzoyl)-1-(2-phenylethyl)spiro[indole-3,3'-pyrrolidine]-2-one (CID 134788843) is 1'-(4-chlorobenzoyl)-1-(2-phenylethyl)spiro[indole-3,3'-pyrrolidine]-2-one.
What is the SMILES notation for 1'-(4-chlorobenzoyl)-1-(2-phenylethyl)spiro[indole-3,3'-pyrrolidine]-2-one?
The canonical SMILES for 1'-(4-chlorobenzoyl)-1-(2-phenylethyl)spiro[indole-3,3'-pyrrolidine]-2-one is O=C(c1ccc(Cl)cc1)N1CCC2(C1)C(=O)N(CCc1ccccc1)c1ccccc12.
What is the InChIKey of 1'-(4-chlorobenzoyl)-1-(2-phenylethyl)spiro[indole-3,3'-pyrrolidine]-2-one?
The InChIKey is FNOGTHKBZGORSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H23ClN2O2/c27-21-12-10-20(11-13-21)24(30)28-17-15-26(18-28)22-8-4-5-9-23(22)29(25(26)31)16-14-19-6-2-1-3-7-19/h1-13H,14-18H2.
What are the key properties of 1'-(4-chlorobenzoyl)-1-(2-phenylethyl)spiro[indole-3,3'-pyrrolidine]-2-one?
1'-(4-chlorobenzoyl)-1-(2-phenylethyl)spiro[indole-3,3'-pyrrolidine]-2-one has a molecular weight of 430.94 g/mol, XLogP of 4.71, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1'-(4-chlorobenzoyl)-1-(2-phenylethyl)spiro[indole-3,3'-pyrrolidine]-2-one is sourced from PubChem (CID 134788843), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).