3-[(3R)-2-oxo-1,3-dihydroindol-3-yl]-1H-quinoxalin-2-one

C16H11N3O2 — CID 2312767

IUPAC3-[(3R)-2-oxo-1,3-dihydroindol-3-yl]-1H-quinoxalin-2-one
SMILESO=C1Nc2ccccc2[C@@H]1c1nc2ccccc2[nH]c1=O
InChIInChI=1S/C16H11N3O2/c20-15-13(9-5-1-2-6-10(9)18-15)14-16(21)19-12-8-4-3-7-11(12)17-14/h1-8,13H,(H,18,20)(H,19,21)/t13-/m1/s1
InChIKeyKZZBQDOXEGJEEQ-CYBMUJFWSA-N
MW277.28 g/mol
LogP2.01
Rot. Bonds1

About 3-[(3R)-2-oxo-1,3-dihydroindol-3-yl]-1H-quinoxalin-2-one

3-[(3R)-2-oxo-1,3-dihydroindol-3-yl]-1H-quinoxalin-2-one (PubChem CID 2312767) has the molecular formula C16H11N3O2 and a molecular weight of 277.28 g/mol. Its IUPAC name is 3-[(3R)-2-oxo-1,3-dihydroindol-3-yl]-1H-quinoxalin-2-one.

Molecular Properties

Compound Name3-[(3R)-2-oxo-1,3-dihydroindol-3-yl]-1H-quinoxalin-2-one
PubChem CID2312767
Molecular FormulaC16H11N3O2
Molecular Weight277.28 g/mol
Exact Mass277.09
IUPAC Name3-[(3R)-2-oxo-1,3-dihydroindol-3-yl]-1H-quinoxalin-2-one
SMILESO=C1Nc2ccccc2[C@@H]1c1nc2ccccc2[nH]c1=O
InChIInChI=1S/C16H11N3O2/c20-15-13(9-5-1-2-6-10(9)18-15)14-16(21)19-12-8-4-3-7-11(12)17-14/h1-8,13H,(H,18,20)(H,19,21)/t13-/m1/s1
InChIKeyKZZBQDOXEGJEEQ-CYBMUJFWSA-N
XLogP2.01
TPSA74.85 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.28
LogP ≤ 52.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-quinolin-2-yl-1,3-dihydroindol-2-one
CID 58723455
3-(1H-benzimidazol-2-ylmethylamino)-1,3-dihydroindol-2-one
CID 58847286
3-(1H-benzimidazol-2-yl)-5-methylsulfonyl-1,3-dihydroindol-2-one
CID 11667021
3-(4-aminophenyl)-1,3-dihydroindol-2-one
CID 118364316
3-(3,4-dimethyl-1H-pyrrol-2-yl)-1,3-dihydroindol-2-one
CID 151228191
3-(1,3-thiazol-5-yl)-1,3-dihydroindol-2-one
CID 151897433
3-(1H-benzimidazol-2-ylsulfanyl)-1,3,4,5-tetrahydro-1-benzazepin-2-one
CID 42652894
3-(5,6-dimethylpyrrolo[2,1-f][1,2,4]triazin-4-yl)-1,3-dihydroindol-2-one
CID 58584603
3-(2-oxo-1H-pyridin-3-yl)-4-quinolin-2-yl-3,4-dihydro-1H-quinolin-2-one
CID 172996468
3-(4-nitrophenyl)-1,3-dihydroindol-2-one
CID 112758281
3-[(E)-1,2-diamino-2-phenylethenyl]-1H-quinoxalin-2-one
CID 142897064
3-[(E)-hydroxyiminomethyl]-1H-quinoxalin-2-one
CID 137037919

Frequently Asked Questions

What is the IUPAC name of 3-[(3R)-2-oxo-1,3-dihydroindol-3-yl]-1H-quinoxalin-2-one?
The IUPAC name of 3-[(3R)-2-oxo-1,3-dihydroindol-3-yl]-1H-quinoxalin-2-one (CID 2312767) is 3-[(3R)-2-oxo-1,3-dihydroindol-3-yl]-1H-quinoxalin-2-one.
What is the SMILES notation for 3-[(3R)-2-oxo-1,3-dihydroindol-3-yl]-1H-quinoxalin-2-one?
The canonical SMILES for 3-[(3R)-2-oxo-1,3-dihydroindol-3-yl]-1H-quinoxalin-2-one is O=C1Nc2ccccc2[C@@H]1c1nc2ccccc2[nH]c1=O.
What is the InChIKey of 3-[(3R)-2-oxo-1,3-dihydroindol-3-yl]-1H-quinoxalin-2-one?
The InChIKey is KZZBQDOXEGJEEQ-CYBMUJFWSA-N. The full InChI is InChI=1S/C16H11N3O2/c20-15-13(9-5-1-2-6-10(9)18-15)14-16(21)19-12-8-4-3-7-11(12)17-14/h1-8,13H,(H,18,20)(H,19,21)/t13-/m1/s1.
What are the key properties of 3-[(3R)-2-oxo-1,3-dihydroindol-3-yl]-1H-quinoxalin-2-one?
3-[(3R)-2-oxo-1,3-dihydroindol-3-yl]-1H-quinoxalin-2-one has a molecular weight of 277.28 g/mol, XLogP of 2.01, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(3R)-2-oxo-1,3-dihydroindol-3-yl]-1H-quinoxalin-2-one is sourced from PubChem (CID 2312767), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).