2-[2,3-bis(furan-2-yl)quinoxalin-6-yl]-1-pyrrolidin-1-ylethanone;1-(2,3-dimethylquinoxalin-6-yl)-3-naphthalen-1-ylpropan-2-one;2-(2,3-dimethylquinoxalin-6-yl)-1-piperidin-1-ylethanone;2-(2,3-dimethylquinoxalin-6-yl)-1-pyrrolidin-1-ylethanone;1-(2,3-diphenylquinoxalin-6-yl)propan-2-one;2-(2,3-diphenylquinoxalin-6-yl)-1-pyrrolidin-1-ylethanone

C127H120N16O8 — CID 159444070

IUPAC2-[2,3-bis(furan-2-yl)quinoxalin-6-yl]-1-pyrrolidin-1-ylethanone;1-(2,3-dimethylquinoxalin-6-yl)-3-naphthalen-1-ylpropan-2-one;2-(2,3-dimethylquinoxalin-6-yl)-1-piperidin-1-ylethanone;2-(2,3-dimethylquinoxalin-6-yl)-1-pyrrolidin-1-ylethanone;1-(2,3-diphenylquinoxalin-6-yl)propan-2-one;2-(2,3-diphenylquinoxalin-6-yl)-1-pyrrolidin-1-ylethanone
SMILESCC(=O)Cc1ccc2nc(-c3ccccc3)c(-c3ccccc3)nc2c1.Cc1nc2ccc(CC(=O)Cc3cccc4ccccc34)cc2nc1C.Cc1nc2ccc(CC(=O)N3CCCC3)cc2nc1C.Cc1nc2ccc(CC(=O)N3CCCCC3)cc2nc1C.O=C(Cc1ccc2nc(-c3ccccc3)c(-c3ccccc3)nc2c1)N1CCCC1.O=C(Cc1ccc2nc(-c3ccco3)c(-c3ccco3)nc2c1)N1CCCC1
InChIInChI=1S/C26H23N3O.C23H20N2O.C23H18N2O.C22H19N3O3.C17H21N3O.C16H19N3O/c30-24(29-15-7-8-16-29)18-19-13-14-22-23(17-19)28-26(21-11-5-2-6-12-21)25(27-22)20-9-3-1-4-10-20;1-15-16(2)25-23-13-17(10-11-22(23)24-15)12-20(26)14-19-8-5-7-18-6-3-4-9-21(18)19;1-16(26)14-17-12-13-20-21(15-17)25-23(19-10-6-3-7-11-19)22(24-20)18-8-4-2-5-9-18;26-20(25-9-1-2-10-25)14-15-7-8-16-17(13-15)24-22(19-6-4-12-28-19)21(23-16)18-5-3-11-27-18;1-12-13(2)19-16-10-14(6-7-15(16)18-12)11-17(21)20-8-4-3-5-9-20;1-11-12(2)18-15-9-13(5-6-14(15)17-11)10-16(20)19-7-3-4-8-19/h1-6,9-14,17H,7-8,15-16,18H2;3-11,13H,12,14H2,1-2H3;2-13,15H,14H2,1H3;3-8,11-13H,1-2,9-10,14H2;6-7,10H,3-5,8-9,11H2,1-2H3;5-6,9H,3-4,7-8,10H2,1-2H3
InChIKeyLSNRPUOWSGOMSD-UHFFFAOYSA-N
MW1998.46 g/mol
LogP24.51
Rot. Bonds20

About 2-[2,3-bis(furan-2-yl)quinoxalin-6-yl]-1-pyrrolidin-1-ylethanone;1-(2,3-dimethylquinoxalin-6-yl)-3-naphthalen-1-ylpropan-2-one;2-(2,3-dimethylquinoxalin-6-yl)-1-piperidin-1-ylethanone;2-(2,3-dimethylquinoxalin-6-yl)-1-pyrrolidin-1-ylethanone;1-(2,3-diphenylquinoxalin-6-yl)propan-2-one;2-(2,3-diphenylquinoxalin-6-yl)-1-pyrrolidin-1-ylethanone

2-[2,3-bis(furan-2-yl)quinoxalin-6-yl]-1-pyrrolidin-1-ylethanone;1-(2,3-dimethylquinoxalin-6-yl)-3-naphthalen-1-ylpropan-2-one;2-(2,3-dimethylquinoxalin-6-yl)-1-piperidin-1-ylethanone;2-(2,3-dimethylquinoxalin-6-yl)-1-pyrrolidin-1-ylethanone;1-(2,3-diphenylquinoxalin-6-yl)propan-2-one;2-(2,3-diphenylquinoxalin-6-yl)-1-pyrrolidin-1-ylethanone (PubChem CID 159444070) has the molecular formula C127H120N16O8 and a molecular weight of 1998.46 g/mol. Its IUPAC name is 2-[2,3-bis(furan-2-yl)quinoxalin-6-yl]-1-pyrrolidin-1-ylethanone;1-(2,3-dimethylquinoxalin-6-yl)-3-naphthalen-1-ylpropan-2-one;2-(2,3-dimethylquinoxalin-6-yl)-1-piperidin-1-ylethanone;2-(2,3-dimethylquinoxalin-6-yl)-1-pyrrolidin-1-ylethanone;1-(2,3-diphenylquinoxalin-6-yl)propan-2-one;2-(2,3-diphenylquinoxalin-6-yl)-1-pyrrolidin-1-ylethanone.

Molecular Properties

Compound Name2-[2,3-bis(furan-2-yl)quinoxalin-6-yl]-1-pyrrolidin-1-ylethanone;1-(2,3-dimethylquinoxalin-6-yl)-3-naphthalen-1-ylpropan-2-one;2-(2,3-dimethylquinoxalin-6-yl)-1-piperidin-1-ylethanone;2-(2,3-dimethylquinoxalin-6-yl)-1-pyrrolidin-1-ylethanone;1-(2,3-diphenylquinoxalin-6-yl)propan-2-one;2-(2,3-diphenylquinoxalin-6-yl)-1-pyrrolidin-1-ylethanone
PubChem CID159444070
Molecular FormulaC127H120N16O8
Molecular Weight1998.46 g/mol
Exact Mass1996.95
IUPAC Name2-[2,3-bis(furan-2-yl)quinoxalin-6-yl]-1-pyrrolidin-1-ylethanone;1-(2,3-dimethylquinoxalin-6-yl)-3-naphthalen-1-ylpropan-2-one;2-(2,3-dimethylquinoxalin-6-yl)-1-piperidin-1-ylethanone;2-(2,3-dimethylquinoxalin-6-yl)-1-pyrrolidin-1-ylethanone;1-(2,3-diphenylquinoxalin-6-yl)propan-2-one;2-(2,3-diphenylquinoxalin-6-yl)-1-pyrrolidin-1-ylethanone
SMILESCC(=O)Cc1ccc2nc(-c3ccccc3)c(-c3ccccc3)nc2c1.Cc1nc2ccc(CC(=O)Cc3cccc4ccccc34)cc2nc1C.Cc1nc2ccc(CC(=O)N3CCCC3)cc2nc1C.Cc1nc2ccc(CC(=O)N3CCCCC3)cc2nc1C.O=C(Cc1ccc2nc(-c3ccccc3)c(-c3ccccc3)nc2c1)N1CCCC1.O=C(Cc1ccc2nc(-c3ccco3)c(-c3ccco3)nc2c1)N1CCCC1
InChIInChI=1S/C26H23N3O.C23H20N2O.C23H18N2O.C22H19N3O3.C17H21N3O.C16H19N3O/c30-24(29-15-7-8-16-29)18-19-13-14-22-23(17-19)28-26(21-11-5-2-6-12-21)25(27-22)20-9-3-1-4-10-20;1-15-16(2)25-23-13-17(10-11-22(23)24-15)12-20(26)14-19-8-5-7-18-6-3-4-9-21(18)19;1-16(26)14-17-12-13-20-21(15-17)25-23(19-10-6-3-7-11-19)22(24-20)18-8-4-2-5-9-18;26-20(25-9-1-2-10-25)14-15-7-8-16-17(13-15)24-22(19-6-4-12-28-19)21(23-16)18-5-3-11-27-18;1-12-13(2)19-16-10-14(6-7-15(16)18-12)11-17(21)20-8-4-3-5-9-20;1-11-12(2)18-15-9-13(5-6-14(15)17-11)10-16(20)19-7-3-4-8-19/h1-6,9-14,17H,7-8,15-16,18H2;3-11,13H,12,14H2,1-2H3;2-13,15H,14H2,1H3;3-8,11-13H,1-2,9-10,14H2;6-7,10H,3-5,8-9,11H2,1-2H3;5-6,9H,3-4,7-8,10H2,1-2H3
InChIKeyLSNRPUOWSGOMSD-UHFFFAOYSA-N
XLogP24.51
TPSA296.34 Ų
H-Bond Donors
H-Bond Acceptors20
Rotatable Bonds20
Heavy Atoms151
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001998.46
LogP ≤ 524.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1020

Analyze 2-[2,3-bis(furan-2-yl)quinoxalin-6-yl]-1-pyrrolidin-1-ylethanone;1-(2,3-dimethylquinoxalin-6-yl)-3-naphthalen-1-ylpropan-2-one;2-(2,3-dimethylquinoxalin-6-yl)-1-piperidin-1-ylethanone;2-(2,3-dimethylquinoxalin-6-yl)-1-pyrrolidin-1-ylethanone;1-(2,3-diphenylquinoxalin-6-yl)propan-2-one;2-(2,3-diphenylquinoxalin-6-yl)-1-pyrrolidin-1-ylethanone with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-[2,3-bis(furan-2-yl)quinoxalin-6-yl]-1-pyrrolidin-1-ylethanone;1-(2,3-dimethylquinoxalin-6-yl)-3-naphthalen-1-ylpropan-2-one;2-(2,3-dimethylquinoxalin-6-yl)-1-piperidin-1-ylethanone;2-(2,3-dimethylquinoxalin-6-yl)-1-pyrrolidin-1-ylethanone;1-(2,3-diphenylquinoxalin-6-yl)propan-2-one;2-(2,3-diphenylquinoxalin-6-yl)-1-pyrrolidin-1-ylethanone?
The IUPAC name of 2-[2,3-bis(furan-2-yl)quinoxalin-6-yl]-1-pyrrolidin-1-ylethanone;1-(2,3-dimethylquinoxalin-6-yl)-3-naphthalen-1-ylpropan-2-one;2-(2,3-dimethylquinoxalin-6-yl)-1-piperidin-1-ylethanone;2-(2,3-dimethylquinoxalin-6-yl)-1-pyrrolidin-1-ylethanone;1-(2,3-diphenylquinoxalin-6-yl)propan-2-one;2-(2,3-diphenylquinoxalin-6-yl)-1-pyrrolidin-1-ylethanone (CID 159444070) is 2-[2,3-bis(furan-2-yl)quinoxalin-6-yl]-1-pyrrolidin-1-ylethanone;1-(2,3-dimethylquinoxalin-6-yl)-3-naphthalen-1-ylpropan-2-one;2-(2,3-dimethylquinoxalin-6-yl)-1-piperidin-1-ylethanone;2-(2,3-dimethylquinoxalin-6-yl)-1-pyrrolidin-1-ylethanone;1-(2,3-diphenylquinoxalin-6-yl)propan-2-one;2-(2,3-diphenylquinoxalin-6-yl)-1-pyrrolidin-1-ylethanone.
What is the SMILES notation for 2-[2,3-bis(furan-2-yl)quinoxalin-6-yl]-1-pyrrolidin-1-ylethanone;1-(2,3-dimethylquinoxalin-6-yl)-3-naphthalen-1-ylpropan-2-one;2-(2,3-dimethylquinoxalin-6-yl)-1-piperidin-1-ylethanone;2-(2,3-dimethylquinoxalin-6-yl)-1-pyrrolidin-1-ylethanone;1-(2,3-diphenylquinoxalin-6-yl)propan-2-one;2-(2,3-diphenylquinoxalin-6-yl)-1-pyrrolidin-1-ylethanone?
The canonical SMILES for 2-[2,3-bis(furan-2-yl)quinoxalin-6-yl]-1-pyrrolidin-1-ylethanone;1-(2,3-dimethylquinoxalin-6-yl)-3-naphthalen-1-ylpropan-2-one;2-(2,3-dimethylquinoxalin-6-yl)-1-piperidin-1-ylethanone;2-(2,3-dimethylquinoxalin-6-yl)-1-pyrrolidin-1-ylethanone;1-(2,3-diphenylquinoxalin-6-yl)propan-2-one;2-(2,3-diphenylquinoxalin-6-yl)-1-pyrrolidin-1-ylethanone is CC(=O)Cc1ccc2nc(-c3ccccc3)c(-c3ccccc3)nc2c1.Cc1nc2ccc(CC(=O)Cc3cccc4ccccc34)cc2nc1C.Cc1nc2ccc(CC(=O)N3CCCC3)cc2nc1C.Cc1nc2ccc(CC(=O)N3CCCCC3)cc2nc1C.O=C(Cc1ccc2nc(-c3ccccc3)c(-c3ccccc3)nc2c1)N1CCCC1.O=C(Cc1ccc2nc(-c3ccco3)c(-c3ccco3)nc2c1)N1CCCC1.
What is the InChIKey of 2-[2,3-bis(furan-2-yl)quinoxalin-6-yl]-1-pyrrolidin-1-ylethanone;1-(2,3-dimethylquinoxalin-6-yl)-3-naphthalen-1-ylpropan-2-one;2-(2,3-dimethylquinoxalin-6-yl)-1-piperidin-1-ylethanone;2-(2,3-dimethylquinoxalin-6-yl)-1-pyrrolidin-1-ylethanone;1-(2,3-diphenylquinoxalin-6-yl)propan-2-one;2-(2,3-diphenylquinoxalin-6-yl)-1-pyrrolidin-1-ylethanone?
The InChIKey is LSNRPUOWSGOMSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H23N3O.C23H20N2O.C23H18N2O.C22H19N3O3.C17H21N3O.C16H19N3O/c30-24(29-15-7-8-16-29)18-19-13-14-22-23(17-19)28-26(21-11-5-2-6-12-21)25(27-22)20-9-3-1-4-10-20;1-15-16(2)25-23-13-17(10-11-22(23)24-15)12-20(26)14-19-8-5-7-18-6-3-4-9-21(18)19;1-16(26)14-17-12-13-20-21(15-17)25-23(19-10-6-3-7-11-19)22(24-20)18-8-4-2-5-9-18;26-20(25-9-1-2-10-25)14-15-7-8-16-17(13-15)24-22(19-6-4-12-28-19)21(23-16)18-5-3-11-27-18;1-12-13(2)19-16-10-14(6-7-15(16)18-12)11-17(21)20-8-4-3-5-9-20;1-11-12(2)18-15-9-13(5-6-14(15)17-11)10-16(20)19-7-3-4-8-19/h1-6,9-14,17H,7-8,15-16,18H2;3-11,13H,12,14H2,1-2H3;2-13,15H,14H2,1H3;3-8,11-13H,1-2,9-10,14H2;6-7,10H,3-5,8-9,11H2,1-2H3;5-6,9H,3-4,7-8,10H2,1-2H3.
What are the key properties of 2-[2,3-bis(furan-2-yl)quinoxalin-6-yl]-1-pyrrolidin-1-ylethanone;1-(2,3-dimethylquinoxalin-6-yl)-3-naphthalen-1-ylpropan-2-one;2-(2,3-dimethylquinoxalin-6-yl)-1-piperidin-1-ylethanone;2-(2,3-dimethylquinoxalin-6-yl)-1-pyrrolidin-1-ylethanone;1-(2,3-diphenylquinoxalin-6-yl)propan-2-one;2-(2,3-diphenylquinoxalin-6-yl)-1-pyrrolidin-1-ylethanone?
2-[2,3-bis(furan-2-yl)quinoxalin-6-yl]-1-pyrrolidin-1-ylethanone;1-(2,3-dimethylquinoxalin-6-yl)-3-naphthalen-1-ylpropan-2-one;2-(2,3-dimethylquinoxalin-6-yl)-1-piperidin-1-ylethanone;2-(2,3-dimethylquinoxalin-6-yl)-1-pyrrolidin-1-ylethanone;1-(2,3-diphenylquinoxalin-6-yl)propan-2-one;2-(2,3-diphenylquinoxalin-6-yl)-1-pyrrolidin-1-ylethanone has a molecular weight of 1998.46 g/mol, XLogP of 24.51, 20 rotatable bonds, 0 hydrogen bond donors, and 20 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2,3-bis(furan-2-yl)quinoxalin-6-yl]-1-pyrrolidin-1-ylethanone;1-(2,3-dimethylquinoxalin-6-yl)-3-naphthalen-1-ylpropan-2-one;2-(2,3-dimethylquinoxalin-6-yl)-1-piperidin-1-ylethanone;2-(2,3-dimethylquinoxalin-6-yl)-1-pyrrolidin-1-ylethanone;1-(2,3-diphenylquinoxalin-6-yl)propan-2-one;2-(2,3-diphenylquinoxalin-6-yl)-1-pyrrolidin-1-ylethanone is sourced from PubChem (CID 159444070), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).