6-(4-fluoro-3-methylphenyl)-5-quinoxalin-6-ylpyridin-3-amine;6-(4-fluoro-3-methylphenyl)-5-quinoxalin-6-ylpyridine-3-carboxamide;bis(1-[6-(4-fluoro-3-methylphenyl)-5-quinoxalin-6-yl-3-pyridinyl]ethanone);[6-(4-fluoro-3-methylphenyl)-5-quinoxalin-6-yl-3-pyridinyl]-(4-methylpiperazin-1-yl)methanone;[6-(4-fluoro-3-methylphenyl)-5-quinoxalin-6-yl-3-pyridinyl]-morpholin-4-ylmethanone

C136H107F6N23O6 — CID 161483485

IUPAC6-(4-fluoro-3-methylphenyl)-5-quinoxalin-6-ylpyridin-3-amine;6-(4-fluoro-3-methylphenyl)-5-quinoxalin-6-ylpyridine-3-carboxamide;bis(1-[6-(4-fluoro-3-methylphenyl)-5-quinoxalin-6-yl-3-pyridinyl]ethanone);[6-(4-fluoro-3-methylphenyl)-5-quinoxalin-6-yl-3-pyridinyl]-(4-methylpiperazin-1-yl)methanone;[6-(4-fluoro-3-methylphenyl)-5-quinoxalin-6-yl-3-pyridinyl]-morpholin-4-ylmethanone
SMILESCC(=O)c1cnc(-c2ccc(F)c(C)c2)c(-c2ccc3nccnc3c2)c1.CC(=O)c1cnc(-c2ccc(F)c(C)c2)c(-c2ccc3nccnc3c2)c1.Cc1cc(-c2ncc(C(=O)N3CCN(C)CC3)cc2-c2ccc3nccnc3c2)ccc1F.Cc1cc(-c2ncc(C(=O)N3CCOCC3)cc2-c2ccc3nccnc3c2)ccc1F.Cc1cc(-c2ncc(C(N)=O)cc2-c2ccc3nccnc3c2)ccc1F.Cc1cc(-c2ncc(N)cc2-c2ccc3nccnc3c2)ccc1F
InChIInChI=1S/C26H24FN5O.C25H21FN4O2.2C22H16FN3O.C21H15FN4O.C20H15FN4/c1-17-13-19(3-5-22(17)27)25-21(18-4-6-23-24(15-18)29-8-7-28-23)14-20(16-30-25)26(33)32-11-9-31(2)10-12-32;1-16-12-18(2-4-21(16)26)24-20(17-3-5-22-23(14-17)28-7-6-27-22)13-19(15-29-24)25(31)30-8-10-32-11-9-30;2*1-13-9-16(3-5-19(13)23)22-18(10-17(12-26-22)14(2)27)15-4-6-20-21(11-15)25-8-7-24-20;1-12-8-14(2-4-17(12)22)20-16(9-15(11-26-20)21(23)27)13-3-5-18-19(10-13)25-7-6-24-18;1-12-8-14(2-4-17(12)21)20-16(10-15(22)11-25-20)13-3-5-18-19(9-13)24-7-6-23-18/h3-8,13-16H,9-12H2,1-2H3;2-7,12-15H,8-11H2,1H3;2*3-12H,1-2H3;2-11H,1H3,(H2,23,27);2-11H,22H2,1H3
InChIKeyWERBRHHAOHMEHP-UHFFFAOYSA-N
MW2273.49 g/mol
LogP26.78
Rot. Bonds17

About 6-(4-fluoro-3-methylphenyl)-5-quinoxalin-6-ylpyridin-3-amine;6-(4-fluoro-3-methylphenyl)-5-quinoxalin-6-ylpyridine-3-carboxamide;bis(1-[6-(4-fluoro-3-methylphenyl)-5-quinoxalin-6-yl-3-pyridinyl]ethanone);[6-(4-fluoro-3-methylphenyl)-5-quinoxalin-6-yl-3-pyridinyl]-(4-methylpiperazin-1-yl)methanone;[6-(4-fluoro-3-methylphenyl)-5-quinoxalin-6-yl-3-pyridinyl]-morpholin-4-ylmethanone

6-(4-fluoro-3-methylphenyl)-5-quinoxalin-6-ylpyridin-3-amine;6-(4-fluoro-3-methylphenyl)-5-quinoxalin-6-ylpyridine-3-carboxamide;bis(1-[6-(4-fluoro-3-methylphenyl)-5-quinoxalin-6-yl-3-pyridinyl]ethanone);[6-(4-fluoro-3-methylphenyl)-5-quinoxalin-6-yl-3-pyridinyl]-(4-methylpiperazin-1-yl)methanone;[6-(4-fluoro-3-methylphenyl)-5-quinoxalin-6-yl-3-pyridinyl]-morpholin-4-ylmethanone (PubChem CID 161483485) has the molecular formula C136H107F6N23O6 and a molecular weight of 2273.49 g/mol. Its IUPAC name is 6-(4-fluoro-3-methylphenyl)-5-quinoxalin-6-ylpyridin-3-amine;6-(4-fluoro-3-methylphenyl)-5-quinoxalin-6-ylpyridine-3-carboxamide;bis(1-[6-(4-fluoro-3-methylphenyl)-5-quinoxalin-6-yl-3-pyridinyl]ethanone);[6-(4-fluoro-3-methylphenyl)-5-quinoxalin-6-yl-3-pyridinyl]-(4-methylpiperazin-1-yl)methanone;[6-(4-fluoro-3-methylphenyl)-5-quinoxalin-6-yl-3-pyridinyl]-morpholin-4-ylmethanone.

Molecular Properties

Compound Name6-(4-fluoro-3-methylphenyl)-5-quinoxalin-6-ylpyridin-3-amine;6-(4-fluoro-3-methylphenyl)-5-quinoxalin-6-ylpyridine-3-carboxamide;bis(1-[6-(4-fluoro-3-methylphenyl)-5-quinoxalin-6-yl-3-pyridinyl]ethanone);[6-(4-fluoro-3-methylphenyl)-5-quinoxalin-6-yl-3-pyridinyl]-(4-methylpiperazin-1-yl)methanone;[6-(4-fluoro-3-methylphenyl)-5-quinoxalin-6-yl-3-pyridinyl]-morpholin-4-ylmethanone
PubChem CID161483485
Molecular FormulaC136H107F6N23O6
Molecular Weight2273.49 g/mol
Exact Mass2271.87
IUPAC Name6-(4-fluoro-3-methylphenyl)-5-quinoxalin-6-ylpyridin-3-amine;6-(4-fluoro-3-methylphenyl)-5-quinoxalin-6-ylpyridine-3-carboxamide;bis(1-[6-(4-fluoro-3-methylphenyl)-5-quinoxalin-6-yl-3-pyridinyl]ethanone);[6-(4-fluoro-3-methylphenyl)-5-quinoxalin-6-yl-3-pyridinyl]-(4-methylpiperazin-1-yl)methanone;[6-(4-fluoro-3-methylphenyl)-5-quinoxalin-6-yl-3-pyridinyl]-morpholin-4-ylmethanone
SMILESCC(=O)c1cnc(-c2ccc(F)c(C)c2)c(-c2ccc3nccnc3c2)c1.CC(=O)c1cnc(-c2ccc(F)c(C)c2)c(-c2ccc3nccnc3c2)c1.Cc1cc(-c2ncc(C(=O)N3CCN(C)CC3)cc2-c2ccc3nccnc3c2)ccc1F.Cc1cc(-c2ncc(C(=O)N3CCOCC3)cc2-c2ccc3nccnc3c2)ccc1F.Cc1cc(-c2ncc(C(N)=O)cc2-c2ccc3nccnc3c2)ccc1F.Cc1cc(-c2ncc(N)cc2-c2ccc3nccnc3c2)ccc1F
InChIInChI=1S/C26H24FN5O.C25H21FN4O2.2C22H16FN3O.C21H15FN4O.C20H15FN4/c1-17-13-19(3-5-22(17)27)25-21(18-4-6-23-24(15-18)29-8-7-28-23)14-20(16-30-25)26(33)32-11-9-31(2)10-12-32;1-16-12-18(2-4-21(16)26)24-20(17-3-5-22-23(14-17)28-7-6-27-22)13-19(15-29-24)25(31)30-8-10-32-11-9-30;2*1-13-9-16(3-5-19(13)23)22-18(10-17(12-26-22)14(2)27)15-4-6-20-21(11-15)25-8-7-24-20;1-12-8-14(2-4-17(12)22)20-16(9-15(11-26-20)21(23)27)13-3-5-18-19(10-13)25-7-6-24-18;1-12-8-14(2-4-17(12)21)20-16(10-15(22)11-25-20)13-3-5-18-19(9-13)24-7-6-23-18/h3-8,13-16H,9-12H2,1-2H3;2-7,12-15H,8-11H2,1H3;2*3-12H,1-2H3;2-11H,1H3,(H2,23,27);2-11H,22H2,1H3
InChIKeyWERBRHHAOHMEHP-UHFFFAOYSA-N
XLogP26.78
TPSA388.36 Ų
H-Bond Donors2
H-Bond Acceptors26
Rotatable Bonds17
Heavy Atoms171
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002273.49
LogP ≤ 526.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1026

Analyze 6-(4-fluoro-3-methylphenyl)-5-quinoxalin-6-ylpyridin-3-amine;6-(4-fluoro-3-methylphenyl)-5-quinoxalin-6-ylpyridine-3-carboxamide;bis(1-[6-(4-fluoro-3-methylphenyl)-5-quinoxalin-6-yl-3-pyridinyl]ethanone);[6-(4-fluoro-3-methylphenyl)-5-quinoxalin-6-yl-3-pyridinyl]-(4-methylpiperazin-1-yl)methanone;[6-(4-fluoro-3-methylphenyl)-5-quinoxalin-6-yl-3-pyridinyl]-morpholin-4-ylmethanone with MolForge

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Launch Full Analysis

Related Compounds

N-[6-(4-fluoro-3-methylphenyl)-5-imidazo[1,2-a]pyridin-6-yl-3-pyridinyl]morpholine-4-carboxamide
CID 90094843
1-[4-[5-(morpholine-4-carbonyl)-3-pyridinyl]phenyl]ethanone
CID 42845751
2-[[6-(4-fluoro-3-methylphenyl)-5-quinoxalin-6-yl-3-pyridinyl]methoxy]-N,N-dimethylacetamide
CID 90094760
5-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-1H-indazole-7-carboxylic acid;[5-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-1H-indazol-7-yl]-morpholin-4-ylmethanone
CID 159506571
[4-(2,3-dihydro-1-benzofuran-5-carbonyl)piperazin-1-yl]-(4-fluoro-3-methylphenyl)methanone
CID 110814917
2,6-difluoro-4-(morpholine-4-carbonyl)benzamide
CID 68557409
1-[3-[[5-(morpholine-4-carbonyl)pyrimidin-2-yl]amino]phenyl]ethanone
CID 109252160
[7-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-1-methyl-2H-quinolizin-4-yl]-morpholin-4-ylmethanone
CID 167216670
(3-amino-5-fluoro-4-methylphenyl)-morpholin-4-ylmethanone
CID 54927621
[2-(3-chloro-4-fluorophenyl)-4-pyridinyl]-morpholin-4-ylmethanone
CID 71187412
(7-fluoroquinolin-3-yl)-(4-methylpiperazin-1-yl)methanone
CID 110489748
N-[6-(4-fluoro-3-methylphenyl)-5-imidazo[1,2-a]pyridin-6-yl-3-pyridinyl]-2-morpholin-4-ylacetamide
CID 123332581

Frequently Asked Questions

What is the IUPAC name of 6-(4-fluoro-3-methylphenyl)-5-quinoxalin-6-ylpyridin-3-amine;6-(4-fluoro-3-methylphenyl)-5-quinoxalin-6-ylpyridine-3-carboxamide;bis(1-[6-(4-fluoro-3-methylphenyl)-5-quinoxalin-6-yl-3-pyridinyl]ethanone);[6-(4-fluoro-3-methylphenyl)-5-quinoxalin-6-yl-3-pyridinyl]-(4-methylpiperazin-1-yl)methanone;[6-(4-fluoro-3-methylphenyl)-5-quinoxalin-6-yl-3-pyridinyl]-morpholin-4-ylmethanone?
The IUPAC name of 6-(4-fluoro-3-methylphenyl)-5-quinoxalin-6-ylpyridin-3-amine;6-(4-fluoro-3-methylphenyl)-5-quinoxalin-6-ylpyridine-3-carboxamide;bis(1-[6-(4-fluoro-3-methylphenyl)-5-quinoxalin-6-yl-3-pyridinyl]ethanone);[6-(4-fluoro-3-methylphenyl)-5-quinoxalin-6-yl-3-pyridinyl]-(4-methylpiperazin-1-yl)methanone;[6-(4-fluoro-3-methylphenyl)-5-quinoxalin-6-yl-3-pyridinyl]-morpholin-4-ylmethanone (CID 161483485) is 6-(4-fluoro-3-methylphenyl)-5-quinoxalin-6-ylpyridin-3-amine;6-(4-fluoro-3-methylphenyl)-5-quinoxalin-6-ylpyridine-3-carboxamide;bis(1-[6-(4-fluoro-3-methylphenyl)-5-quinoxalin-6-yl-3-pyridinyl]ethanone);[6-(4-fluoro-3-methylphenyl)-5-quinoxalin-6-yl-3-pyridinyl]-(4-methylpiperazin-1-yl)methanone;[6-(4-fluoro-3-methylphenyl)-5-quinoxalin-6-yl-3-pyridinyl]-morpholin-4-ylmethanone.
What is the SMILES notation for 6-(4-fluoro-3-methylphenyl)-5-quinoxalin-6-ylpyridin-3-amine;6-(4-fluoro-3-methylphenyl)-5-quinoxalin-6-ylpyridine-3-carboxamide;bis(1-[6-(4-fluoro-3-methylphenyl)-5-quinoxalin-6-yl-3-pyridinyl]ethanone);[6-(4-fluoro-3-methylphenyl)-5-quinoxalin-6-yl-3-pyridinyl]-(4-methylpiperazin-1-yl)methanone;[6-(4-fluoro-3-methylphenyl)-5-quinoxalin-6-yl-3-pyridinyl]-morpholin-4-ylmethanone?
The canonical SMILES for 6-(4-fluoro-3-methylphenyl)-5-quinoxalin-6-ylpyridin-3-amine;6-(4-fluoro-3-methylphenyl)-5-quinoxalin-6-ylpyridine-3-carboxamide;bis(1-[6-(4-fluoro-3-methylphenyl)-5-quinoxalin-6-yl-3-pyridinyl]ethanone);[6-(4-fluoro-3-methylphenyl)-5-quinoxalin-6-yl-3-pyridinyl]-(4-methylpiperazin-1-yl)methanone;[6-(4-fluoro-3-methylphenyl)-5-quinoxalin-6-yl-3-pyridinyl]-morpholin-4-ylmethanone is CC(=O)c1cnc(-c2ccc(F)c(C)c2)c(-c2ccc3nccnc3c2)c1.CC(=O)c1cnc(-c2ccc(F)c(C)c2)c(-c2ccc3nccnc3c2)c1.Cc1cc(-c2ncc(C(=O)N3CCN(C)CC3)cc2-c2ccc3nccnc3c2)ccc1F.Cc1cc(-c2ncc(C(=O)N3CCOCC3)cc2-c2ccc3nccnc3c2)ccc1F.Cc1cc(-c2ncc(C(N)=O)cc2-c2ccc3nccnc3c2)ccc1F.Cc1cc(-c2ncc(N)cc2-c2ccc3nccnc3c2)ccc1F.
What is the InChIKey of 6-(4-fluoro-3-methylphenyl)-5-quinoxalin-6-ylpyridin-3-amine;6-(4-fluoro-3-methylphenyl)-5-quinoxalin-6-ylpyridine-3-carboxamide;bis(1-[6-(4-fluoro-3-methylphenyl)-5-quinoxalin-6-yl-3-pyridinyl]ethanone);[6-(4-fluoro-3-methylphenyl)-5-quinoxalin-6-yl-3-pyridinyl]-(4-methylpiperazin-1-yl)methanone;[6-(4-fluoro-3-methylphenyl)-5-quinoxalin-6-yl-3-pyridinyl]-morpholin-4-ylmethanone?
The InChIKey is WERBRHHAOHMEHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H24FN5O.C25H21FN4O2.2C22H16FN3O.C21H15FN4O.C20H15FN4/c1-17-13-19(3-5-22(17)27)25-21(18-4-6-23-24(15-18)29-8-7-28-23)14-20(16-30-25)26(33)32-11-9-31(2)10-12-32;1-16-12-18(2-4-21(16)26)24-20(17-3-5-22-23(14-17)28-7-6-27-22)13-19(15-29-24)25(31)30-8-10-32-11-9-30;2*1-13-9-16(3-5-19(13)23)22-18(10-17(12-26-22)14(2)27)15-4-6-20-21(11-15)25-8-7-24-20;1-12-8-14(2-4-17(12)22)20-16(9-15(11-26-20)21(23)27)13-3-5-18-19(10-13)25-7-6-24-18;1-12-8-14(2-4-17(12)21)20-16(10-15(22)11-25-20)13-3-5-18-19(9-13)24-7-6-23-18/h3-8,13-16H,9-12H2,1-2H3;2-7,12-15H,8-11H2,1H3;2*3-12H,1-2H3;2-11H,1H3,(H2,23,27);2-11H,22H2,1H3.
What are the key properties of 6-(4-fluoro-3-methylphenyl)-5-quinoxalin-6-ylpyridin-3-amine;6-(4-fluoro-3-methylphenyl)-5-quinoxalin-6-ylpyridine-3-carboxamide;bis(1-[6-(4-fluoro-3-methylphenyl)-5-quinoxalin-6-yl-3-pyridinyl]ethanone);[6-(4-fluoro-3-methylphenyl)-5-quinoxalin-6-yl-3-pyridinyl]-(4-methylpiperazin-1-yl)methanone;[6-(4-fluoro-3-methylphenyl)-5-quinoxalin-6-yl-3-pyridinyl]-morpholin-4-ylmethanone?
6-(4-fluoro-3-methylphenyl)-5-quinoxalin-6-ylpyridin-3-amine;6-(4-fluoro-3-methylphenyl)-5-quinoxalin-6-ylpyridine-3-carboxamide;bis(1-[6-(4-fluoro-3-methylphenyl)-5-quinoxalin-6-yl-3-pyridinyl]ethanone);[6-(4-fluoro-3-methylphenyl)-5-quinoxalin-6-yl-3-pyridinyl]-(4-methylpiperazin-1-yl)methanone;[6-(4-fluoro-3-methylphenyl)-5-quinoxalin-6-yl-3-pyridinyl]-morpholin-4-ylmethanone has a molecular weight of 2273.49 g/mol, XLogP of 26.78, 17 rotatable bonds, 2 hydrogen bond donors, and 26 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-fluoro-3-methylphenyl)-5-quinoxalin-6-ylpyridin-3-amine;6-(4-fluoro-3-methylphenyl)-5-quinoxalin-6-ylpyridine-3-carboxamide;bis(1-[6-(4-fluoro-3-methylphenyl)-5-quinoxalin-6-yl-3-pyridinyl]ethanone);[6-(4-fluoro-3-methylphenyl)-5-quinoxalin-6-yl-3-pyridinyl]-(4-methylpiperazin-1-yl)methanone;[6-(4-fluoro-3-methylphenyl)-5-quinoxalin-6-yl-3-pyridinyl]-morpholin-4-ylmethanone is sourced from PubChem (CID 161483485), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).