1'-[(4-methoxyphenyl)methyl]-1-phenylspiro[indole-3,3'-pyrrolidine]-2-one

C25H24N2O2 — CID 134789856

IUPAC1'-[(4-methoxyphenyl)methyl]-1-phenylspiro[indole-3,3'-pyrrolidine]-2-one
SMILESCOc1ccc(CN2CCC3(C2)C(=O)N(c2ccccc2)c2ccccc23)cc1
InChIInChI=1S/C25H24N2O2/c1-29-21-13-11-19(12-14-21)17-26-16-15-25(18-26)22-9-5-6-10-23(22)27(24(25)28)20-7-3-2-4-8-20/h2-14H,15-18H2,1H3
InChIKeyPYZMPSIGFLDKEI-UHFFFAOYSA-N
MW384.48 g/mol
LogP4.52
Rot. Bonds4

About 1'-[(4-methoxyphenyl)methyl]-1-phenylspiro[indole-3,3'-pyrrolidine]-2-one

1'-[(4-methoxyphenyl)methyl]-1-phenylspiro[indole-3,3'-pyrrolidine]-2-one (PubChem CID 134789856) has the molecular formula C25H24N2O2 and a molecular weight of 384.48 g/mol. Its IUPAC name is 1'-[(4-methoxyphenyl)methyl]-1-phenylspiro[indole-3,3'-pyrrolidine]-2-one.

Molecular Properties

Compound Name1'-[(4-methoxyphenyl)methyl]-1-phenylspiro[indole-3,3'-pyrrolidine]-2-one
PubChem CID134789856
Molecular FormulaC25H24N2O2
Molecular Weight384.48 g/mol
Exact Mass384.18
IUPAC Name1'-[(4-methoxyphenyl)methyl]-1-phenylspiro[indole-3,3'-pyrrolidine]-2-one
SMILESCOc1ccc(CN2CCC3(C2)C(=O)N(c2ccccc2)c2ccccc23)cc1
InChIInChI=1S/C25H24N2O2/c1-29-21-13-11-19(12-14-21)17-26-16-15-25(18-26)22-9-5-6-10-23(22)27(24(25)28)20-7-3-2-4-8-20/h2-14H,15-18H2,1H3
InChIKeyPYZMPSIGFLDKEI-UHFFFAOYSA-N
XLogP4.52
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.48
LogP ≤ 54.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-Acetyl-3,3-bis(4-(acetyloxy)phenyl)-1,3-dihydro-2H-indol-2-one
CID 29321
1-[3-(4-Methoxyphenyl)propanoyl]-2-methylindoline
CID 2971574
3-Ethyl-3-{4-[4-(4-methoxyphenyl)-piperazin-1-yl]-butyl}-1,3-dihydro-2H-indol-2-one
CID 24854186
1-Benzyl-3-ethyl-3-[4-[4-(2-methoxyphenyl)piperazin-1-yl]butyl]indol-2-one
CID 24854269
3-Ethyl-3-{4-[4-(3-methoxyphenyl)-piperazin-1-yl]-butyl}-1,3-dihydro-2H-indol-2-one
CID 24854369
(3Z)-1-[(4-methoxyphenyl)methyl]-3-[(E)-3-(4-nitrophenyl)prop-2-enylidene]indol-2-one
CID 122182272
(3E)-1-[(4-methoxyphenyl)methyl]-3-[(E)-3-(4-nitrophenyl)prop-2-enylidene]indol-2-one
CID 122182273
1-[(4-Methoxyphenyl)methyl]-5-phenylindole-2,3-dione
CID 139255412
5-(4-Fluorophenyl)-1-[(4-methoxyphenyl)methyl]indole-2,3-dione
CID 141372276
5-(4-Methoxyphenyl)-1-[(4-methoxyphenyl)methyl]indole-2,3-dione
CID 141372279
1-[(4-Methoxyphenyl)methyl]-5-(4-methylphenyl)indole-2,3-dione
CID 141372282
1-[3-(4-Methoxyphenyl)propanoyl]indoline
CID 898384

Frequently Asked Questions

What is the IUPAC name of 1'-[(4-methoxyphenyl)methyl]-1-phenylspiro[indole-3,3'-pyrrolidine]-2-one?
The IUPAC name of 1'-[(4-methoxyphenyl)methyl]-1-phenylspiro[indole-3,3'-pyrrolidine]-2-one (CID 134789856) is 1'-[(4-methoxyphenyl)methyl]-1-phenylspiro[indole-3,3'-pyrrolidine]-2-one.
What is the SMILES notation for 1'-[(4-methoxyphenyl)methyl]-1-phenylspiro[indole-3,3'-pyrrolidine]-2-one?
The canonical SMILES for 1'-[(4-methoxyphenyl)methyl]-1-phenylspiro[indole-3,3'-pyrrolidine]-2-one is COc1ccc(CN2CCC3(C2)C(=O)N(c2ccccc2)c2ccccc23)cc1.
What is the InChIKey of 1'-[(4-methoxyphenyl)methyl]-1-phenylspiro[indole-3,3'-pyrrolidine]-2-one?
The InChIKey is PYZMPSIGFLDKEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H24N2O2/c1-29-21-13-11-19(12-14-21)17-26-16-15-25(18-26)22-9-5-6-10-23(22)27(24(25)28)20-7-3-2-4-8-20/h2-14H,15-18H2,1H3.
What are the key properties of 1'-[(4-methoxyphenyl)methyl]-1-phenylspiro[indole-3,3'-pyrrolidine]-2-one?
1'-[(4-methoxyphenyl)methyl]-1-phenylspiro[indole-3,3'-pyrrolidine]-2-one has a molecular weight of 384.48 g/mol, XLogP of 4.52, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1'-[(4-methoxyphenyl)methyl]-1-phenylspiro[indole-3,3'-pyrrolidine]-2-one is sourced from PubChem (CID 134789856), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).