5-[1-(2-bicyclo[2.2.1]heptanyl)piperidin-4-yl]-1,3-dihydroindol-2-one

C20H26N2O — CID 69349761

IUPAC5-[1-(2-bicyclo[2.2.1]heptanyl)piperidin-4-yl]-1,3-dihydroindol-2-one
SMILESO=C1Cc2cc(C3CCN(C4CC5CCC4C5)CC3)ccc2N1
InChIInChI=1S/C20H26N2O/c23-20-12-17-11-15(3-4-18(17)21-20)14-5-7-22(8-6-14)19-10-13-1-2-16(19)9-13/h3-4,11,13-14,16,19H,1-2,5-10,12H2,(H,21,23)
InChIKeyBAGOOYKNYOZQHZ-UHFFFAOYSA-N
MW310.44 g/mol
LogP3.55
Rot. Bonds2

About 5-[1-(2-bicyclo[2.2.1]heptanyl)piperidin-4-yl]-1,3-dihydroindol-2-one

5-[1-(2-bicyclo[2.2.1]heptanyl)piperidin-4-yl]-1,3-dihydroindol-2-one (PubChem CID 69349761) has the molecular formula C20H26N2O and a molecular weight of 310.44 g/mol. Its IUPAC name is 5-[1-(2-bicyclo[2.2.1]heptanyl)piperidin-4-yl]-1,3-dihydroindol-2-one.

Molecular Properties

Compound Name5-[1-(2-bicyclo[2.2.1]heptanyl)piperidin-4-yl]-1,3-dihydroindol-2-one
PubChem CID69349761
Molecular FormulaC20H26N2O
Molecular Weight310.44 g/mol
Exact Mass310.20
IUPAC Name5-[1-(2-bicyclo[2.2.1]heptanyl)piperidin-4-yl]-1,3-dihydroindol-2-one
SMILESO=C1Cc2cc(C3CCN(C4CC5CCC4C5)CC3)ccc2N1
InChIInChI=1S/C20H26N2O/c23-20-12-17-11-15(3-4-18(17)21-20)14-5-7-22(8-6-14)19-10-13-1-2-16(19)9-13/h3-4,11,13-14,16,19H,1-2,5-10,12H2,(H,21,23)
InChIKeyBAGOOYKNYOZQHZ-UHFFFAOYSA-N
XLogP3.55
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.44
LogP ≤ 53.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 5-[1-(2-bicyclo[2.2.1]heptanyl)piperidin-4-yl]-1,3-dihydroindol-2-one with MolForge

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Related Compounds

5-cyclopentyl-1,3-dihydroindol-2-one
CID 23363851
1-[1-(2-bicyclo[2.2.1]heptanyl)piperidin-4-yl]-3H-indol-2-one
CID 22558083
1-(2-bicyclo[2.2.1]heptanyl)-4-(2-fluorophenyl)piperidine
CID 58772016
5-(3-oxopiperazin-2-yl)-1,3-dihydroindol-2-one
CID 82289120
5-(2-methylmorpholin-3-yl)-1,3-dihydroindol-2-one
CID 82289606
5-(1-ethyl-2-oxoimidazolidin-4-yl)-1,3-dihydroindol-2-one
CID 116980989
1-[(1S,4S)-2-bicyclo[2.2.1]heptanyl]-4-(2,5-dimethoxyphenyl)piperidine
CID 58772326
5-pyrrolidin-1-yl-1,3-dihydroindol-2-one
CID 23363883
4-[3-[1-[(1S,2S,4S)-2-bicyclo[2.2.1]heptanyl]piperidin-4-yl]-4-methoxyphenyl]aniline
CID 88979595
1-[(1S,2S,4S)-2-bicyclo[2.2.1]heptanyl]-4-[2-(4-methylphenyl)phenyl]piperidine
CID 58772170
5-thiomorpholin-3-yl-1,3-dihydroindol-2-one
CID 82290766
N-[(1S,8aS)-1,2,3,5,6,7,8,8a-octahydroindolizin-1-yl]-4-(2-oxo-1,3-dihydroindol-5-yl)butanamide
CID 100904249

Frequently Asked Questions

What is the IUPAC name of 5-[1-(2-bicyclo[2.2.1]heptanyl)piperidin-4-yl]-1,3-dihydroindol-2-one?
The IUPAC name of 5-[1-(2-bicyclo[2.2.1]heptanyl)piperidin-4-yl]-1,3-dihydroindol-2-one (CID 69349761) is 5-[1-(2-bicyclo[2.2.1]heptanyl)piperidin-4-yl]-1,3-dihydroindol-2-one.
What is the SMILES notation for 5-[1-(2-bicyclo[2.2.1]heptanyl)piperidin-4-yl]-1,3-dihydroindol-2-one?
The canonical SMILES for 5-[1-(2-bicyclo[2.2.1]heptanyl)piperidin-4-yl]-1,3-dihydroindol-2-one is O=C1Cc2cc(C3CCN(C4CC5CCC4C5)CC3)ccc2N1.
What is the InChIKey of 5-[1-(2-bicyclo[2.2.1]heptanyl)piperidin-4-yl]-1,3-dihydroindol-2-one?
The InChIKey is BAGOOYKNYOZQHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N2O/c23-20-12-17-11-15(3-4-18(17)21-20)14-5-7-22(8-6-14)19-10-13-1-2-16(19)9-13/h3-4,11,13-14,16,19H,1-2,5-10,12H2,(H,21,23).
What are the key properties of 5-[1-(2-bicyclo[2.2.1]heptanyl)piperidin-4-yl]-1,3-dihydroindol-2-one?
5-[1-(2-bicyclo[2.2.1]heptanyl)piperidin-4-yl]-1,3-dihydroindol-2-one has a molecular weight of 310.44 g/mol, XLogP of 3.55, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[1-(2-bicyclo[2.2.1]heptanyl)piperidin-4-yl]-1,3-dihydroindol-2-one is sourced from PubChem (CID 69349761), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).