1'-[(E)-3-(4-methoxyphenyl)prop-2-enyl]spiro[1H-indole-3,4'-piperidine]-2-one

C22H24N2O2 — CID 56903074

IUPAC1'-[(E)-3-(4-methoxyphenyl)prop-2-enyl]spiro[1H-indole-3,4'-piperidine]-2-one
SMILESCOc1ccc(/C=C/CN2CCC3(CC2)C(=O)Nc2ccccc23)cc1
InChIInChI=1S/C22H24N2O2/c1-26-18-10-8-17(9-11-18)5-4-14-24-15-12-22(13-16-24)19-6-2-3-7-20(19)23-21(22)25/h2-11H,12-16H2,1H3,(H,23,25)/b5-4+
InChIKeyFBLNPJGTSSSWJH-SNAWJCMRSA-N
MW348.45 g/mol
LogP3.69
Rot. Bonds4

About 1'-[(E)-3-(4-methoxyphenyl)prop-2-enyl]spiro[1H-indole-3,4'-piperidine]-2-one

1'-[(E)-3-(4-methoxyphenyl)prop-2-enyl]spiro[1H-indole-3,4'-piperidine]-2-one (PubChem CID 56903074) has the molecular formula C22H24N2O2 and a molecular weight of 348.45 g/mol. Its IUPAC name is 1'-[(E)-3-(4-methoxyphenyl)prop-2-enyl]spiro[1H-indole-3,4'-piperidine]-2-one.

Molecular Properties

Compound Name1'-[(E)-3-(4-methoxyphenyl)prop-2-enyl]spiro[1H-indole-3,4'-piperidine]-2-one
PubChem CID56903074
Molecular FormulaC22H24N2O2
Molecular Weight348.45 g/mol
Exact Mass348.18
IUPAC Name1'-[(E)-3-(4-methoxyphenyl)prop-2-enyl]spiro[1H-indole-3,4'-piperidine]-2-one
SMILESCOc1ccc(/C=C/CN2CCC3(CC2)C(=O)Nc2ccccc23)cc1
InChIInChI=1S/C22H24N2O2/c1-26-18-10-8-17(9-11-18)5-4-14-24-15-12-22(13-16-24)19-6-2-3-7-20(19)23-21(22)25/h2-11H,12-16H2,1H3,(H,23,25)/b5-4+
InChIKeyFBLNPJGTSSSWJH-SNAWJCMRSA-N
XLogP3.69
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.45
LogP ≤ 53.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1'-ethylspiro[1H-indole-3,4'-piperidine]-2-one
CID 3042076
1'-[2-(3-methoxyphenyl)sulfanylacetyl]spiro[1H-indole-3,4'-piperidine]-2-one
CID 59862913
1'-propylspiro[1H-indole-3,3'-pyrrolidine]-2-one;hydrochloride
CID 3042074
(3S,4S)-1-[(E)-3-(4-methoxyphenyl)prop-2-enyl]-4-methylpiperidine-3,4-diol
CID 72897547
1'-[(5-fluoro-2-methoxyphenyl)methyl]spiro[1H-indole-3,4'-piperidine]-2-one
CID 56884415
spiro[1H-indole-3,1'-cyclopropane]-2-one;hydrochloride
CID 141126988
1-[(E)-3-(4-methoxyphenyl)prop-2-enyl]-3-(pyrrolidin-1-ylmethyl)piperidin-3-ol
CID 70771000
9-[(E)-3-(4-methoxyphenyl)prop-2-enyl]-4-methyl-1-oxa-9-azaspiro[5.5]undec-4-ene
CID 135103504
1'-[[4-(2-hydroxyethoxy)phenyl]methyl]spiro[1H-indole-3,4'-piperidine]-2-one
CID 74251453
9-[3-(4-methoxyphenyl)prop-2-enyl]-4-methyl-1-oxa-9-azaspiro[5.5]undec-4-ene
CID 171146672
1'-(5-methoxy-3-methyl-1H-indole-2-carbonyl)spiro[1H-indole-3,4'-piperidine]-2-one
CID 68811952
1'-(2,4-dimethoxybenzoyl)spiro[1H-indole-3,3'-pyrrolidine]-2-one
CID 53176938

Frequently Asked Questions

What is the IUPAC name of 1'-[(E)-3-(4-methoxyphenyl)prop-2-enyl]spiro[1H-indole-3,4'-piperidine]-2-one?
The IUPAC name of 1'-[(E)-3-(4-methoxyphenyl)prop-2-enyl]spiro[1H-indole-3,4'-piperidine]-2-one (CID 56903074) is 1'-[(E)-3-(4-methoxyphenyl)prop-2-enyl]spiro[1H-indole-3,4'-piperidine]-2-one.
What is the SMILES notation for 1'-[(E)-3-(4-methoxyphenyl)prop-2-enyl]spiro[1H-indole-3,4'-piperidine]-2-one?
The canonical SMILES for 1'-[(E)-3-(4-methoxyphenyl)prop-2-enyl]spiro[1H-indole-3,4'-piperidine]-2-one is COc1ccc(/C=C/CN2CCC3(CC2)C(=O)Nc2ccccc23)cc1.
What is the InChIKey of 1'-[(E)-3-(4-methoxyphenyl)prop-2-enyl]spiro[1H-indole-3,4'-piperidine]-2-one?
The InChIKey is FBLNPJGTSSSWJH-SNAWJCMRSA-N. The full InChI is InChI=1S/C22H24N2O2/c1-26-18-10-8-17(9-11-18)5-4-14-24-15-12-22(13-16-24)19-6-2-3-7-20(19)23-21(22)25/h2-11H,12-16H2,1H3,(H,23,25)/b5-4+.
What are the key properties of 1'-[(E)-3-(4-methoxyphenyl)prop-2-enyl]spiro[1H-indole-3,4'-piperidine]-2-one?
1'-[(E)-3-(4-methoxyphenyl)prop-2-enyl]spiro[1H-indole-3,4'-piperidine]-2-one has a molecular weight of 348.45 g/mol, XLogP of 3.69, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1'-[(E)-3-(4-methoxyphenyl)prop-2-enyl]spiro[1H-indole-3,4'-piperidine]-2-one is sourced from PubChem (CID 56903074), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).