3,3-dimethyl-1-(2-oxo-2-piperidin-1-ylethyl)indol-2-one

C17H22N2O2 — CID 51691258

IUPAC3,3-dimethyl-1-(2-oxo-2-piperidin-1-ylethyl)indol-2-one
SMILESCC1(C)C(=O)N(CC(=O)N2CCCCC2)c2ccccc21
InChIInChI=1S/C17H22N2O2/c1-17(2)13-8-4-5-9-14(13)19(16(17)21)12-15(20)18-10-6-3-7-11-18/h4-5,8-9H,3,6-7,10-12H2,1-2H3
InChIKeyJTQIUOCANOIVHZ-UHFFFAOYSA-N
MW286.37 g/mol
LogP2.32
Rot. Bonds2

About 3,3-dimethyl-1-(2-oxo-2-piperidin-1-ylethyl)indol-2-one

3,3-dimethyl-1-(2-oxo-2-piperidin-1-ylethyl)indol-2-one (PubChem CID 51691258) has the molecular formula C17H22N2O2 and a molecular weight of 286.37 g/mol. Its IUPAC name is 3,3-dimethyl-1-(2-oxo-2-piperidin-1-ylethyl)indol-2-one.

Molecular Properties

Compound Name3,3-dimethyl-1-(2-oxo-2-piperidin-1-ylethyl)indol-2-one
PubChem CID51691258
Molecular FormulaC17H22N2O2
Molecular Weight286.37 g/mol
Exact Mass286.17
IUPAC Name3,3-dimethyl-1-(2-oxo-2-piperidin-1-ylethyl)indol-2-one
SMILESCC1(C)C(=O)N(CC(=O)N2CCCCC2)c2ccccc21
InChIInChI=1S/C17H22N2O2/c1-17(2)13-8-4-5-9-14(13)19(16(17)21)12-15(20)18-10-6-3-7-11-18/h4-5,8-9H,3,6-7,10-12H2,1-2H3
InChIKeyJTQIUOCANOIVHZ-UHFFFAOYSA-N
XLogP2.32
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.37
LogP ≤ 52.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3,3-dimethyl-1-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]indol-2-one
CID 58834365
(5S)-5-(2-chlorophenyl)-5-methyl-3-(2-oxo-2-piperidin-1-ylethyl)imidazolidine-2,4-dione
CID 2702291
(5S)-5-(2-fluorophenyl)-5-methyl-3-(2-oxo-2-pyrrolidin-1-ylethyl)imidazolidine-2,4-dione
CID 94797964
5-methyl-3-(2-oxo-2-pyrrolidin-1-ylethyl)-5-phenylimidazolidine-2,4-dione
CID 3874337
(3S)-3'-(2-oxo-2-piperidin-1-ylethyl)spiro[1,2-dihydroindene-3,5'-imidazolidine]-2',4'-dione
CID 2702948
(5R)-5-tert-butyl-3-(2-oxo-2-piperidin-1-ylethyl)-5-phenylimidazolidine-2,4-dione
CID 7263656
3,3-dimethyl-5-[(3S)-3-methylpiperidin-1-yl]sulfonyl-1-(2-oxo-2-piperidin-1-ylethyl)indol-2-one
CID 93056067
(4R)-3'-(2-oxo-2-piperidin-1-ylethyl)spiro[2,3-dihydro-1H-naphthalene-4,5'-imidazolidine]-2',4'-dione
CID 2706127
(4S)-3'-[2-(azepan-1-yl)-2-oxoethyl]spiro[2,3-dihydro-1H-naphthalene-4,5'-imidazolidine]-2',4'-dione
CID 2705993
N-(cyclopropylmethyl)-2-(3,3-dimethyl-2-oxoindol-1-yl)-N-methylacetamide
CID 95748634
(2S)-2-methyl-4-(2-oxo-2-piperidin-1-ylethyl)-1,4-benzoxazin-3-one
CID 1455485
2-(1H-indazol-3-yl)-7,7-dimethyl-5-(2-oxo-2-piperidin-1-ylethyl)-1H-pyrrolo[2,3-f]benzimidazol-6-one
CID 135461273

Frequently Asked Questions

What is the IUPAC name of 3,3-dimethyl-1-(2-oxo-2-piperidin-1-ylethyl)indol-2-one?
The IUPAC name of 3,3-dimethyl-1-(2-oxo-2-piperidin-1-ylethyl)indol-2-one (CID 51691258) is 3,3-dimethyl-1-(2-oxo-2-piperidin-1-ylethyl)indol-2-one.
What is the SMILES notation for 3,3-dimethyl-1-(2-oxo-2-piperidin-1-ylethyl)indol-2-one?
The canonical SMILES for 3,3-dimethyl-1-(2-oxo-2-piperidin-1-ylethyl)indol-2-one is CC1(C)C(=O)N(CC(=O)N2CCCCC2)c2ccccc21.
What is the InChIKey of 3,3-dimethyl-1-(2-oxo-2-piperidin-1-ylethyl)indol-2-one?
The InChIKey is JTQIUOCANOIVHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2O2/c1-17(2)13-8-4-5-9-14(13)19(16(17)21)12-15(20)18-10-6-3-7-11-18/h4-5,8-9H,3,6-7,10-12H2,1-2H3.
What are the key properties of 3,3-dimethyl-1-(2-oxo-2-piperidin-1-ylethyl)indol-2-one?
3,3-dimethyl-1-(2-oxo-2-piperidin-1-ylethyl)indol-2-one has a molecular weight of 286.37 g/mol, XLogP of 2.32, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3-dimethyl-1-(2-oxo-2-piperidin-1-ylethyl)indol-2-one is sourced from PubChem (CID 51691258), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).