N-(4-acetylphenyl)-3-(4-fluoro-2-methoxyphenoxy)quinoxaline-2-carboxamide;N-(3-ethynylphenyl)-3-(4-fluoro-2-methoxyphenoxy)quinoxaline-2-carboxamide;3-(4-fluoro-2-methoxyphenoxy)-N-(2-oxo-1,3-dihydroindol-6-yl)quinoxaline-2-carboxamide

C72H51F3N10O11 — CID 159499754

About N-(4-acetylphenyl)-3-(4-fluoro-2-methoxyphenoxy)quinoxaline-2-carboxamide;N-(3-ethynylphenyl)-3-(4-fluoro-2-methoxyphenoxy)quinoxaline-2-carboxamide;3-(4-fluoro-2-methoxyphenoxy)-N-(2-oxo-1,3-dihydroindol-6-yl)quinoxaline-2-carboxamide

N-(4-acetylphenyl)-3-(4-fluoro-2-methoxyphenoxy)quinoxaline-2-carboxamide;N-(3-ethynylphenyl)-3-(4-fluoro-2-methoxyphenoxy)quinoxaline-2-carboxamide;3-(4-fluoro-2-methoxyphenoxy)-N-(2-oxo-1,3-dihydroindol-6-yl)quinoxaline-2-carboxamide (PubChem CID 159499754) has the molecular formula C72H51F3N10O11 and a molecular weight of 1289.25 g/mol. Its IUPAC name is N-(4-acetylphenyl)-3-(4-fluoro-2-methoxyphenoxy)quinoxaline-2-carboxamide;N-(3-ethynylphenyl)-3-(4-fluoro-2-methoxyphenoxy)quinoxaline-2-carboxamide;3-(4-fluoro-2-methoxyphenoxy)-N-(2-oxo-1,3-dihydroindol-6-yl)quinoxaline-2-carboxamide.

Molecular Properties

• Compound Name: N-(4-acetylphenyl)-3-(4-fluoro-2-methoxyphenoxy)quinoxaline-2-carboxamide;N-(3-ethynylphenyl)-3-(4-fluoro-2-methoxyphenoxy)quinoxaline-2-carboxamide;3-(4-fluoro-2-methoxyphenoxy)-N-(2-oxo-1,3-dihydroindol-6-yl)quinoxaline-2-carboxamide
• PubChem CID: 159499754
• Molecular Formula: C72H51F3N10O11
• Molecular Weight: 1289.25 g/mol
• Exact Mass: 1288.37
• IUPAC Name: N-(4-acetylphenyl)-3-(4-fluoro-2-methoxyphenoxy)quinoxaline-2-carboxamide;N-(3-ethynylphenyl)-3-(4-fluoro-2-methoxyphenoxy)quinoxaline-2-carboxamide;3-(4-fluoro-2-methoxyphenoxy)-N-(2-oxo-1,3-dihydroindol-6-yl)quinoxaline-2-carboxamide
• SMILES: C#Cc1cccc(NC(=O)c2nc3ccccc3nc2Oc2ccc(F)cc2OC)c1.COc1cc(F)ccc1Oc1nc2ccccc2nc1C(=O)Nc1ccc(C(C)=O)cc1.COc1cc(F)ccc1Oc1nc2ccccc2nc1C(=O)Nc1ccc2c(c1)NC(=O)C2
• InChI: InChI=1S/C24H17FN4O4.C24H18FN3O4.C24H16FN3O3/c1-32-20-11-14(25)7-9-19(20)33-24-22(28-16-4-2-3-5-17(16)29-24)23(31)26-15-8-6-13-10-21(30)27-18(13)12-15;1-14(29)15-7-10-17(11-8-15)26-23(30)22-24(28-19-6-4-3-5-18(19)27-22)32-20-12-9-16(25)13-21(20)31-2;1-3-15-7-6-8-17(13-15)26-23(29)22-24(28-19-10-5-4-9-18(19)27-22)31-20-12-11-16(25)14-21(20)30-2/h2-9,11-12H,10H2,1H3,(H,26,31)(H,27,30);3-13H,1-2H3,(H,26,30);1,4-14H,2H3,(H,26,29)
• InChIKey: LZFRMQPKORAOSA-UHFFFAOYSA-N
• XLogP: 14.14
• TPSA: 266.19 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 17
• Rotatable Bonds: 16
• Heavy Atoms: 96
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1289.25
LogP ≤ 5	14.14
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	17

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'triple_bond', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of N-(4-acetylphenyl)-3-(4-fluoro-2-methoxyphenoxy)quinoxaline-2-carboxamide;N-(3-ethynylphenyl)-3-(4-fluoro-2-methoxyphenoxy)quinoxaline-2-carboxamide;3-(4-fluoro-2-methoxyphenoxy)-N-(2-oxo-1,3-dihydroindol-6-yl)quinoxaline-2-carboxamide?

The IUPAC name of N-(4-acetylphenyl)-3-(4-fluoro-2-methoxyphenoxy)quinoxaline-2-carboxamide;N-(3-ethynylphenyl)-3-(4-fluoro-2-methoxyphenoxy)quinoxaline-2-carboxamide;3-(4-fluoro-2-methoxyphenoxy)-N-(2-oxo-1,3-dihydroindol-6-yl)quinoxaline-2-carboxamide (CID 159499754) is N-(4-acetylphenyl)-3-(4-fluoro-2-methoxyphenoxy)quinoxaline-2-carboxamide;N-(3-ethynylphenyl)-3-(4-fluoro-2-methoxyphenoxy)quinoxaline-2-carboxamide;3-(4-fluoro-2-methoxyphenoxy)-N-(2-oxo-1,3-dihydroindol-6-yl)quinoxaline-2-carboxamide.

What is the SMILES notation for N-(4-acetylphenyl)-3-(4-fluoro-2-methoxyphenoxy)quinoxaline-2-carboxamide;N-(3-ethynylphenyl)-3-(4-fluoro-2-methoxyphenoxy)quinoxaline-2-carboxamide;3-(4-fluoro-2-methoxyphenoxy)-N-(2-oxo-1,3-dihydroindol-6-yl)quinoxaline-2-carboxamide?

The canonical SMILES for N-(4-acetylphenyl)-3-(4-fluoro-2-methoxyphenoxy)quinoxaline-2-carboxamide;N-(3-ethynylphenyl)-3-(4-fluoro-2-methoxyphenoxy)quinoxaline-2-carboxamide;3-(4-fluoro-2-methoxyphenoxy)-N-(2-oxo-1,3-dihydroindol-6-yl)quinoxaline-2-carboxamide is C#Cc1cccc(NC(=O)c2nc3ccccc3nc2Oc2ccc(F)cc2OC)c1.COc1cc(F)ccc1Oc1nc2ccccc2nc1C(=O)Nc1ccc(C(C)=O)cc1.COc1cc(F)ccc1Oc1nc2ccccc2nc1C(=O)Nc1ccc2c(c1)NC(=O)C2.

What is the InChIKey of N-(4-acetylphenyl)-3-(4-fluoro-2-methoxyphenoxy)quinoxaline-2-carboxamide;N-(3-ethynylphenyl)-3-(4-fluoro-2-methoxyphenoxy)quinoxaline-2-carboxamide;3-(4-fluoro-2-methoxyphenoxy)-N-(2-oxo-1,3-dihydroindol-6-yl)quinoxaline-2-carboxamide?

The InChIKey is LZFRMQPKORAOSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H17FN4O4.C24H18FN3O4.C24H16FN3O3/c1-32-20-11-14(25)7-9-19(20)33-24-22(28-16-4-2-3-5-17(16)29-24)23(31)26-15-8-6-13-10-21(30)27-18(13)12-15;1-14(29)15-7-10-17(11-8-15)26-23(30)22-24(28-19-6-4-3-5-18(19)27-22)32-20-12-9-16(25)13-21(20)31-2;1-3-15-7-6-8-17(13-15)26-23(29)22-24(28-19-10-5-4-9-18(19)27-22)31-20-12-11-16(25)14-21(20)30-2/h2-9,11-12H,10H2,1H3,(H,26,31)(H,27,30);3-13H,1-2H3,(H,26,30);1,4-14H,2H3,(H,26,29).

What are the key properties of N-(4-acetylphenyl)-3-(4-fluoro-2-methoxyphenoxy)quinoxaline-2-carboxamide;N-(3-ethynylphenyl)-3-(4-fluoro-2-methoxyphenoxy)quinoxaline-2-carboxamide;3-(4-fluoro-2-methoxyphenoxy)-N-(2-oxo-1,3-dihydroindol-6-yl)quinoxaline-2-carboxamide?

N-(4-acetylphenyl)-3-(4-fluoro-2-methoxyphenoxy)quinoxaline-2-carboxamide;N-(3-ethynylphenyl)-3-(4-fluoro-2-methoxyphenoxy)quinoxaline-2-carboxamide;3-(4-fluoro-2-methoxyphenoxy)-N-(2-oxo-1,3-dihydroindol-6-yl)quinoxaline-2-carboxamide has a molecular weight of 1289.25 g/mol, XLogP of 14.14, 16 rotatable bonds, 4 hydrogen bond donors, and 17 hydrogen bond acceptors.

Where does this data come from?

All data for N-(4-acetylphenyl)-3-(4-fluoro-2-methoxyphenoxy)quinoxaline-2-carboxamide;N-(3-ethynylphenyl)-3-(4-fluoro-2-methoxyphenoxy)quinoxaline-2-carboxamide;3-(4-fluoro-2-methoxyphenoxy)-N-(2-oxo-1,3-dihydroindol-6-yl)quinoxaline-2-carboxamide is sourced from PubChem (CID 159499754), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).