2-(1,3-benzodioxol-5-yl)-3-[methyl(propan-2-yl)amino]furo[2,3-b]pyrazine-6-carboxylic acid;2-(5-fluoro-1-benzofuran-2-yl)-3-[methyl(propan-2-yl)amino]furo[2,3-b]pyrazine-6-carboxylic acid;5-(4-fluorophenyl)-6-[methyl(propan-2-yl)amino]-[1,3]oxazolo[4,5-b]pyrazine-2-carboxylic acid;3-[methyl(propan-2-yl)amino]-2-naphthalen-2-ylfuro[2,3-b]pyrazine-6-carboxylic acid;3-[methyl(propan-2-yl)amino]-2-pyridin-3-ylfuro[2,3-b]pyrazine-6-carboxylic acid;3-morpholin-4-yl-2-propan-2-ylfuro[2,3-b]pyrazine-6-carboxylic acid;3-piperidin-1-yl-2-propan-2-ylfuro[2,3-b]pyrazine-6-carboxylic acid

C119H119F2N23O25 — CID 159442100

IUPAC2-(1,3-benzodioxol-5-yl)-3-[methyl(propan-2-yl)amino]furo[2,3-b]pyrazine-6-carboxylic acid;2-(5-fluoro-1-benzofuran-2-yl)-3-[methyl(propan-2-yl)amino]furo[2,3-b]pyrazine-6-carboxylic acid;5-(4-fluorophenyl)-6-[methyl(propan-2-yl)amino]-[1,3]oxazolo[4,5-b]pyrazine-2-carboxylic acid;3-[methyl(propan-2-yl)amino]-2-naphthalen-2-ylfuro[2,3-b]pyrazine-6-carboxylic acid;3-[methyl(propan-2-yl)amino]-2-pyridin-3-ylfuro[2,3-b]pyrazine-6-carboxylic acid;3-morpholin-4-yl-2-propan-2-ylfuro[2,3-b]pyrazine-6-carboxylic acid;3-piperidin-1-yl-2-propan-2-ylfuro[2,3-b]pyrazine-6-carboxylic acid
SMILESCC(C)N(C)c1nc2oc(C(=O)O)cc2nc1-c1cc2cc(F)ccc2o1.CC(C)N(C)c1nc2oc(C(=O)O)cc2nc1-c1ccc2c(c1)OCO2.CC(C)N(C)c1nc2oc(C(=O)O)cc2nc1-c1ccc2ccccc2c1.CC(C)N(C)c1nc2oc(C(=O)O)cc2nc1-c1cccnc1.CC(C)N(C)c1nc2oc(C(=O)O)nc2nc1-c1ccc(F)cc1.CC(C)c1nc2cc(C(=O)O)oc2nc1N1CCCCC1.CC(C)c1nc2cc(C(=O)O)oc2nc1N1CCOCC1
InChIInChI=1S/C21H19N3O3.C19H16FN3O4.C18H17N3O5.C16H15FN4O3.C16H16N4O3.C15H19N3O3.C14H17N3O4/c1-12(2)24(3)19-18(15-9-8-13-6-4-5-7-14(13)10-15)22-16-11-17(21(25)26)27-20(16)23-19;1-9(2)23(3)17-16(14-7-10-6-11(20)4-5-13(10)26-14)21-12-8-15(19(24)25)27-18(12)22-17;1-9(2)21(3)16-15(10-4-5-12-13(6-10)25-8-24-12)19-11-7-14(18(22)23)26-17(11)20-16;1-8(2)21(3)13-11(9-4-6-10(17)7-5-9)18-12-14(20-13)24-15(19-12)16(22)23;1-9(2)20(3)14-13(10-5-4-6-17-8-10)18-11-7-12(16(21)22)23-15(11)19-14;1-9(2)12-13(18-6-4-3-5-7-18)17-14-10(16-12)8-11(21-14)15(19)20;1-8(2)11-12(17-3-5-20-6-4-17)16-13-9(15-11)7-10(21-13)14(18)19/h4-12H,1-3H3,(H,25,26);4-9H,1-3H3,(H,24,25);4-7,9H,8H2,1-3H3,(H,22,23);4-8H,1-3H3,(H,22,23);4-9H,1-3H3,(H,21,22);8-9H,3-7H2,1-2H3,(H,19,20);7-8H,3-6H2,1-2H3,(H,18,19)
InChIKeyLSHKPPNHYAGYBB-UHFFFAOYSA-N
MW2309.39 g/mol
LogP22.77
Rot. Bonds26

About 2-(1,3-benzodioxol-5-yl)-3-[methyl(propan-2-yl)amino]furo[2,3-b]pyrazine-6-carboxylic acid;2-(5-fluoro-1-benzofuran-2-yl)-3-[methyl(propan-2-yl)amino]furo[2,3-b]pyrazine-6-carboxylic acid;5-(4-fluorophenyl)-6-[methyl(propan-2-yl)amino]-[1,3]oxazolo[4,5-b]pyrazine-2-carboxylic acid;3-[methyl(propan-2-yl)amino]-2-naphthalen-2-ylfuro[2,3-b]pyrazine-6-carboxylic acid;3-[methyl(propan-2-yl)amino]-2-pyridin-3-ylfuro[2,3-b]pyrazine-6-carboxylic acid;3-morpholin-4-yl-2-propan-2-ylfuro[2,3-b]pyrazine-6-carboxylic acid;3-piperidin-1-yl-2-propan-2-ylfuro[2,3-b]pyrazine-6-carboxylic acid

2-(1,3-benzodioxol-5-yl)-3-[methyl(propan-2-yl)amino]furo[2,3-b]pyrazine-6-carboxylic acid;2-(5-fluoro-1-benzofuran-2-yl)-3-[methyl(propan-2-yl)amino]furo[2,3-b]pyrazine-6-carboxylic acid;5-(4-fluorophenyl)-6-[methyl(propan-2-yl)amino]-[1,3]oxazolo[4,5-b]pyrazine-2-carboxylic acid;3-[methyl(propan-2-yl)amino]-2-naphthalen-2-ylfuro[2,3-b]pyrazine-6-carboxylic acid;3-[methyl(propan-2-yl)amino]-2-pyridin-3-ylfuro[2,3-b]pyrazine-6-carboxylic acid;3-morpholin-4-yl-2-propan-2-ylfuro[2,3-b]pyrazine-6-carboxylic acid;3-piperidin-1-yl-2-propan-2-ylfuro[2,3-b]pyrazine-6-carboxylic acid (PubChem CID 159442100) has the molecular formula C119H119F2N23O25 and a molecular weight of 2309.39 g/mol. Its IUPAC name is 2-(1,3-benzodioxol-5-yl)-3-[methyl(propan-2-yl)amino]furo[2,3-b]pyrazine-6-carboxylic acid;2-(5-fluoro-1-benzofuran-2-yl)-3-[methyl(propan-2-yl)amino]furo[2,3-b]pyrazine-6-carboxylic acid;5-(4-fluorophenyl)-6-[methyl(propan-2-yl)amino]-[1,3]oxazolo[4,5-b]pyrazine-2-carboxylic acid;3-[methyl(propan-2-yl)amino]-2-naphthalen-2-ylfuro[2,3-b]pyrazine-6-carboxylic acid;3-[methyl(propan-2-yl)amino]-2-pyridin-3-ylfuro[2,3-b]pyrazine-6-carboxylic acid;3-morpholin-4-yl-2-propan-2-ylfuro[2,3-b]pyrazine-6-carboxylic acid;3-piperidin-1-yl-2-propan-2-ylfuro[2,3-b]pyrazine-6-carboxylic acid.

Molecular Properties

Compound Name2-(1,3-benzodioxol-5-yl)-3-[methyl(propan-2-yl)amino]furo[2,3-b]pyrazine-6-carboxylic acid;2-(5-fluoro-1-benzofuran-2-yl)-3-[methyl(propan-2-yl)amino]furo[2,3-b]pyrazine-6-carboxylic acid;5-(4-fluorophenyl)-6-[methyl(propan-2-yl)amino]-[1,3]oxazolo[4,5-b]pyrazine-2-carboxylic acid;3-[methyl(propan-2-yl)amino]-2-naphthalen-2-ylfuro[2,3-b]pyrazine-6-carboxylic acid;3-[methyl(propan-2-yl)amino]-2-pyridin-3-ylfuro[2,3-b]pyrazine-6-carboxylic acid;3-morpholin-4-yl-2-propan-2-ylfuro[2,3-b]pyrazine-6-carboxylic acid;3-piperidin-1-yl-2-propan-2-ylfuro[2,3-b]pyrazine-6-carboxylic acid
PubChem CID159442100
Molecular FormulaC119H119F2N23O25
Molecular Weight2309.39 g/mol
Exact Mass2307.87
IUPAC Name2-(1,3-benzodioxol-5-yl)-3-[methyl(propan-2-yl)amino]furo[2,3-b]pyrazine-6-carboxylic acid;2-(5-fluoro-1-benzofuran-2-yl)-3-[methyl(propan-2-yl)amino]furo[2,3-b]pyrazine-6-carboxylic acid;5-(4-fluorophenyl)-6-[methyl(propan-2-yl)amino]-[1,3]oxazolo[4,5-b]pyrazine-2-carboxylic acid;3-[methyl(propan-2-yl)amino]-2-naphthalen-2-ylfuro[2,3-b]pyrazine-6-carboxylic acid;3-[methyl(propan-2-yl)amino]-2-pyridin-3-ylfuro[2,3-b]pyrazine-6-carboxylic acid;3-morpholin-4-yl-2-propan-2-ylfuro[2,3-b]pyrazine-6-carboxylic acid;3-piperidin-1-yl-2-propan-2-ylfuro[2,3-b]pyrazine-6-carboxylic acid
SMILESCC(C)N(C)c1nc2oc(C(=O)O)cc2nc1-c1cc2cc(F)ccc2o1.CC(C)N(C)c1nc2oc(C(=O)O)cc2nc1-c1ccc2c(c1)OCO2.CC(C)N(C)c1nc2oc(C(=O)O)cc2nc1-c1ccc2ccccc2c1.CC(C)N(C)c1nc2oc(C(=O)O)cc2nc1-c1cccnc1.CC(C)N(C)c1nc2oc(C(=O)O)nc2nc1-c1ccc(F)cc1.CC(C)c1nc2cc(C(=O)O)oc2nc1N1CCCCC1.CC(C)c1nc2cc(C(=O)O)oc2nc1N1CCOCC1
InChIInChI=1S/C21H19N3O3.C19H16FN3O4.C18H17N3O5.C16H15FN4O3.C16H16N4O3.C15H19N3O3.C14H17N3O4/c1-12(2)24(3)19-18(15-9-8-13-6-4-5-7-14(13)10-15)22-16-11-17(21(25)26)27-20(16)23-19;1-9(2)23(3)17-16(14-7-10-6-11(20)4-5-13(10)26-14)21-12-8-15(19(24)25)27-18(12)22-17;1-9(2)21(3)16-15(10-4-5-12-13(6-10)25-8-24-12)19-11-7-14(18(22)23)26-17(11)20-16;1-8(2)21(3)13-11(9-4-6-10(17)7-5-9)18-12-14(20-13)24-15(19-12)16(22)23;1-9(2)20(3)14-13(10-5-4-6-17-8-10)18-11-7-12(16(21)22)23-15(11)19-14;1-9(2)12-13(18-6-4-3-5-7-18)17-14-10(16-12)8-11(21-14)15(19)20;1-8(2)11-12(17-3-5-20-6-4-17)16-13-9(15-11)7-10(21-13)14(18)19/h4-12H,1-3H3,(H,25,26);4-9H,1-3H3,(H,24,25);4-7,9H,8H2,1-3H3,(H,22,23);4-8H,1-3H3,(H,22,23);4-9H,1-3H3,(H,21,22);8-9H,3-7H2,1-2H3,(H,19,20);7-8H,3-6H2,1-2H3,(H,18,19)
InChIKeyLSHKPPNHYAGYBB-UHFFFAOYSA-N
XLogP22.77
TPSA622.83 Ų
H-Bond Donors7
H-Bond Acceptors41
Rotatable Bonds26
Heavy Atoms169
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002309.39
LogP ≤ 522.77
H-Bond Donors ≤ 57
H-Bond Acceptors ≤ 1041

Analyze 2-(1,3-benzodioxol-5-yl)-3-[methyl(propan-2-yl)amino]furo[2,3-b]pyrazine-6-carboxylic acid;2-(5-fluoro-1-benzofuran-2-yl)-3-[methyl(propan-2-yl)amino]furo[2,3-b]pyrazine-6-carboxylic acid;5-(4-fluorophenyl)-6-[methyl(propan-2-yl)amino]-[1,3]oxazolo[4,5-b]pyrazine-2-carboxylic acid;3-[methyl(propan-2-yl)amino]-2-naphthalen-2-ylfuro[2,3-b]pyrazine-6-carboxylic acid;3-[methyl(propan-2-yl)amino]-2-pyridin-3-ylfuro[2,3-b]pyrazine-6-carboxylic acid;3-morpholin-4-yl-2-propan-2-ylfuro[2,3-b]pyrazine-6-carboxylic acid;3-piperidin-1-yl-2-propan-2-ylfuro[2,3-b]pyrazine-6-carboxylic acid with MolForge

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Related Compounds

3-(1,3-benzodioxol-5-yl)-1-[(3R)-3-[3-(1,1-difluoroethyl)benzoyl]piperidin-1-yl]propan-1-one;1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(5-phenyl-1,3,4-oxadiazol-2-yl)ethanone;[3-(2-fluorophenyl)-1,2-oxazol-5-yl]-(4-phenylpiperazin-1-yl)methanone;N-methyl-4-[(1-methylimidazol-2-yl)methoxy]-N-[[4-(trifluoromethyl)phenyl]methyl]benzamide;[2-oxo-2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]ethyl] 1-hydroxycyclohexane-1-carboxylate;1-[[3-(phenoxymethyl)-1,2,4-oxadiazol-5-yl]methyl]-4-[3-(trifluoromethyl)phenyl]piperidin-4-ol;(3S)-1-phenyl-3-[4-(pyridin-2-ylmethoxy)piperidine-1-carbonyl]pyrrolidin-2-one
CID 158330552
ethyl 9-ethyl-2-methyl-4,9a-dihydro-3aH-furo[3,2-b]quinoxaline-3-carboxylate;5-methoxy-2,3-dimethyl-1-[2-(6-methyl-3-pyridinyl)ethyl]indole;6-methoxy-3-methyl-2,3,4,9-tetrahydropyrido[3,4-b]indol-1-one;4-methyl-2-(2-methylphenyl)-6-piperazin-1-ylpyrimidine;24-methyl-5,18,20-trioxahexacyclo[11.11.0.02,10.04,8.014,22.017,21]tetracosa-2(10),3,8,14(22),15,17(21)-hexaen-12-ol;N-(4-morpholin-4-ylphenyl)-2,3-dihydro-1,4-dioxine-5-carboxamide;2-phenyl-2-(trifluoromethyl)-6,7-dihydro-3H-imidazo[2,1-b][1,3,5]oxadiazin-4-one
CID 158586768
Ethane;1-methyl-2-(3-methyldibenzofuran-4-yl)pyridin-1-ium;7-methyl-6-(1-methylpyridin-1-ium-2-yl)-[1]benzofuro[3,2-b]pyridine;7-methyl-8-(1-methylpyridin-1-ium-2-yl)-[1]benzofuro[2,3-b]pyridine;7-methyl-6-(1-methylpyridin-1-ium-2-yl)-[1]benzofuro[3,2-c]pyridine;7-methyl-8-(1-methylpyridin-1-ium-2-yl)-[1]benzofuro[2,3-c]pyridine;2-(2-methylphenyl)-1-phenylimidazole
CID 157103548
3-(azepan-1-yl)-2-(4-fluorophenyl)furo[2,3-b]pyrazine-6-carboxylic acid;2-(1-benzofuran-2-yl)-3-[methyl(propan-2-yl)amino]furo[2,3-b]pyrazine-6-carboxylic acid;3-[cyclohexyl(methyl)amino]-2-(4-fluorophenyl)furo[2,3-b]pyrazine-6-carboxylic acid;2-cyclohexyl-3-[methyl(propan-2-yl)amino]furo[2,3-b]pyrazine-6-carboxylic acid;3-(3,4-dihydro-2H-quinolin-1-yl)-2-(4-fluorophenyl)furo[2,3-b]pyrazine-6-carboxylic acid;2-(4-fluorophenyl)-3-(N-methylanilino)furo[2,3-b]pyrazine-6-carboxylic acid
CID 157132229
3-(Azepan-1-yl)-2-(4-fluorophenyl)furo[2,3-b]pyrazine-6-carboxylic acid;2-(1,3-benzodioxol-5-yl)-3-[methyl(propan-2-yl)amino]furo[2,3-b]pyrazine-6-carboxylic acid;2-(1-benzofuran-2-yl)-3-[methyl(propan-2-yl)amino]furo[2,3-b]pyrazine-6-carboxylic acid;3-[cyclohexyl(methyl)amino]-2-(4-fluorophenyl)furo[2,3-b]pyrazine-6-carboxylic acid;2-cyclohexyl-3-[methyl(propan-2-yl)amino]furo[2,3-b]pyrazine-6-carboxylic acid;3-morpholin-4-yl-2-propan-2-ylfuro[2,3-b]pyrazine-6-carboxylic acid
CID 157258420
5,7-dimethyl-1-benzofuran;6,8-dimethyl-2,3-dihydro-[1,4]dioxino[2,3-b]pyridine;5,7-dimethyl-2,3-dihydrofuro[3,2-b]pyridine;4,7-dimethyl-2,3-dihydrofuro[3,2-c]pyridine;6,8-dimethyl-3,4-dihydro-2H-pyrano[3,2-b]pyridine;5,8-dimethyl-3,4-dihydro-2H-pyrano[3,2-c]pyridine;5,7-dimethylfuro[3,2-b]pyridine;ethane;6-methoxy-2,5-dimethyl-3H-isoindol-1-one;4-methoxy-2,5-dimethylpyrimidine;2-methoxy-1,3,4,5-tetramethylbenzene;2-methoxy-3,5,6-trimethylpyridine;3-methoxy-2,4,6-trimethylpyridine;4-methoxy-2,3,5-trimethylpyridine;7-methyl-5H-furo[3,2-c]pyridin-4-one;4,5,7-trimethyl-1,3-benzodioxole;5,6,8-trimethyl-2,3-dihydro-1,4-benzodioxine;4,5,7-trimethyl-2,3-dihydro-1-benzofuran;5,6,8-trimethyl-3,4-dihydro-2H-chromene;4,5,7-trimethyl-2,3-dihydrofuro[2,3-c]pyridine
CID 157267282
7-(10-Dibenzofuran-2-ylanthracen-9-yl)-[1]benzofuro[3,2-g]pteridine;13-[10-(4-dibenzofuran-2-ylphenyl)anthracen-9-yl]-17-oxa-2,4,6,9,14-pentazatetracyclo[8.7.0.03,8.011,16]heptadeca-1,3,5,7,9,11,13,15-octaene;13-(10-naphthalen-2-ylanthracen-9-yl)-17-oxa-2,4,9-triazatetracyclo[8.7.0.03,8.011,16]heptadeca-1,3(8),4,6,9,11(16),12,14-octaene;13-[10-(4-naphthalen-1-ylphenyl)anthracen-9-yl]-17-oxa-2,14-diazatetracyclo[8.7.0.03,8.011,16]heptadeca-1,3,5,7,9,11,13,15-octaene;13-[10-(17-oxa-2,6,14-triazatetracyclo[8.7.0.03,8.011,16]heptadeca-1(10),2,4,6,8,11,13,15-octaen-13-yl)anthracen-9-yl]-17-oxa-2,6,14-triazatetracyclo[8.7.0.03,8.011,16]heptadeca-1(10),2,4,6,8,11,13,15-octaene
CID 157647697
2-(1,3-benzodioxol-5-yl)-3-[methyl(propan-2-yl)amino]-5H-cyclopenta[b]pyrazine-6-carboxylic acid;2-(5-fluoro-1-benzofuran-2-yl)-3-[methyl(propan-2-yl)amino]-5H-cyclopenta[b]pyrazine-6-carboxylic acid;3-[methyl(propan-2-yl)amino]-2-naphthalen-2-yl-5H-cyclopenta[b]pyrazine-6-carboxylic acid;3-[methyl(propan-2-yl)amino]-2-pyridin-3-yl-5H-cyclopenta[b]pyrazine-6-carboxylic acid;3-morpholin-4-yl-2-propan-2-yl-5H-cyclopenta[b]pyrazine-6-carboxylic acid
CID 157969870
2-(1,3-benzodioxol-5-yl)-3-[methyl(propan-2-yl)amino]-5H-cyclopenta[b]pyrazine-6-carboxylic acid;2-(1-benzofuran-2-yl)-3-[methyl(propan-2-yl)amino]-5H-cyclopenta[b]pyrazine-6-carboxylic acid;2-cyclopentyl-3-[methyl(propan-2-yl)amino]-5H-cyclopenta[b]pyrazine-6-carboxylic acid;2-(5-fluoro-1-benzofuran-2-yl)-3-[methyl(propan-2-yl)amino]-5H-cyclopenta[b]pyrazine-6-carboxylic acid;3-[methyl(propan-2-yl)amino]-2-naphthalen-2-yl-5H-cyclopenta[b]pyrazine-6-carboxylic acid;3-[methyl(propan-2-yl)amino]-2-pyridin-3-yl-5H-cyclopenta[b]pyrazine-6-carboxylic acid;3-morpholin-4-yl-2-propan-2-yl-5H-cyclopenta[b]pyrazine-6-carboxylic acid
CID 157973764
2-(1,3-benzodioxol-5-yl)-3-[methyl(propan-2-yl)amino]pyrido[2,3-b]pyrazine-6-carboxylic acid;2-(1-benzofuran-2-yl)-3-[methyl(propan-2-yl)amino]pyrido[2,3-b]pyrazine-6-carboxylic acid;3-ethyl-2-(4-fluorophenyl)pyrido[2,3-b]pyrazine-6-carboxylic acid;2-(4-fluorophenyl)-7-methoxy-3-[methyl(pyridin-3-yl)amino]pyrido[2,3-b]pyrazine-6-carboxylic acid;2-(4-fluorophenyl)-3-[methyl(propan-2-yl)amino]pyrido[2,3-b]pyrazine-6-carboxylic acid;2-(4-fluorophenyl)-3-morpholin-4-ylpyrido[2,3-b]pyrazine-6-carboxamide;N-methyl-N-propan-2-yl-2-pyridin-3-yl-6-(2H-tetrazol-5-yl)pyrido[2,3-b]pyrazin-3-amine
CID 158099367
2-(5-Fluoro-1-benzofuran-2-yl)-3-[methyl(propan-2-yl)amino]furo[2,3-b]pyrazine-6-carboxylic acid;5-(4-fluorophenyl)-6-[methyl(propan-2-yl)amino]-[1,3]oxazolo[4,5-b]pyrazine-2-carboxylic acid;5-(4-fluorophenyl)-6-piperidin-1-yl-[1,3]oxazolo[4,5-b]pyrazine-2-carboxylic acid;3-[methyl(propan-2-yl)amino]-2-naphthalen-2-ylfuro[2,3-b]pyrazine-6-carboxylic acid;3-[methyl(propan-2-yl)amino]-2-pyridin-3-ylfuro[2,3-b]pyrazine-6-carboxylic acid;3-piperidin-1-yl-2-propan-2-ylfuro[2,3-b]pyrazine-6-carboxylic acid
CID 158248214
5,7-dimethyl-1-benzofuran;6,8-dimethyl-2,3-dihydro-[1,4]dioxino[2,3-b]pyridine;5,7-dimethyl-2,3-dihydrofuro[3,2-b]pyridine;4,7-dimethyl-2,3-dihydrofuro[3,2-c]pyridine;6,8-dimethyl-3,4-dihydro-2H-pyrano[3,2-b]pyridine;5,7-dimethylfuro[3,2-b]pyridine;ethane;6-methoxy-2,5-dimethyl-3H-isoindol-1-one;4-methoxy-2,5-dimethylpyrimidine;2-methoxy-1,3,4,5-tetramethylbenzene;2-methoxy-3,5,6-trimethylpyridine;3-methoxy-2,4,6-trimethylpyridine;4-methoxy-2,3,5-trimethylpyridine;7-methyl-5H-furo[3,2-c]pyridin-4-one;4,5,7-trimethyl-1,3-benzodioxole;5,6,8-trimethyl-2,3-dihydro-1,4-benzodioxine;4,5,7-trimethyl-2,3-dihydro-1-benzofuran;5,6,8-trimethyl-3,4-dihydro-2H-chromene;4,5,7-trimethyl-2,3-dihydrofuro[2,3-c]pyridine
CID 158360571

Frequently Asked Questions

What is the IUPAC name of 2-(1,3-benzodioxol-5-yl)-3-[methyl(propan-2-yl)amino]furo[2,3-b]pyrazine-6-carboxylic acid;2-(5-fluoro-1-benzofuran-2-yl)-3-[methyl(propan-2-yl)amino]furo[2,3-b]pyrazine-6-carboxylic acid;5-(4-fluorophenyl)-6-[methyl(propan-2-yl)amino]-[1,3]oxazolo[4,5-b]pyrazine-2-carboxylic acid;3-[methyl(propan-2-yl)amino]-2-naphthalen-2-ylfuro[2,3-b]pyrazine-6-carboxylic acid;3-[methyl(propan-2-yl)amino]-2-pyridin-3-ylfuro[2,3-b]pyrazine-6-carboxylic acid;3-morpholin-4-yl-2-propan-2-ylfuro[2,3-b]pyrazine-6-carboxylic acid;3-piperidin-1-yl-2-propan-2-ylfuro[2,3-b]pyrazine-6-carboxylic acid?
The IUPAC name of 2-(1,3-benzodioxol-5-yl)-3-[methyl(propan-2-yl)amino]furo[2,3-b]pyrazine-6-carboxylic acid;2-(5-fluoro-1-benzofuran-2-yl)-3-[methyl(propan-2-yl)amino]furo[2,3-b]pyrazine-6-carboxylic acid;5-(4-fluorophenyl)-6-[methyl(propan-2-yl)amino]-[1,3]oxazolo[4,5-b]pyrazine-2-carboxylic acid;3-[methyl(propan-2-yl)amino]-2-naphthalen-2-ylfuro[2,3-b]pyrazine-6-carboxylic acid;3-[methyl(propan-2-yl)amino]-2-pyridin-3-ylfuro[2,3-b]pyrazine-6-carboxylic acid;3-morpholin-4-yl-2-propan-2-ylfuro[2,3-b]pyrazine-6-carboxylic acid;3-piperidin-1-yl-2-propan-2-ylfuro[2,3-b]pyrazine-6-carboxylic acid (CID 159442100) is 2-(1,3-benzodioxol-5-yl)-3-[methyl(propan-2-yl)amino]furo[2,3-b]pyrazine-6-carboxylic acid;2-(5-fluoro-1-benzofuran-2-yl)-3-[methyl(propan-2-yl)amino]furo[2,3-b]pyrazine-6-carboxylic acid;5-(4-fluorophenyl)-6-[methyl(propan-2-yl)amino]-[1,3]oxazolo[4,5-b]pyrazine-2-carboxylic acid;3-[methyl(propan-2-yl)amino]-2-naphthalen-2-ylfuro[2,3-b]pyrazine-6-carboxylic acid;3-[methyl(propan-2-yl)amino]-2-pyridin-3-ylfuro[2,3-b]pyrazine-6-carboxylic acid;3-morpholin-4-yl-2-propan-2-ylfuro[2,3-b]pyrazine-6-carboxylic acid;3-piperidin-1-yl-2-propan-2-ylfuro[2,3-b]pyrazine-6-carboxylic acid.
What is the SMILES notation for 2-(1,3-benzodioxol-5-yl)-3-[methyl(propan-2-yl)amino]furo[2,3-b]pyrazine-6-carboxylic acid;2-(5-fluoro-1-benzofuran-2-yl)-3-[methyl(propan-2-yl)amino]furo[2,3-b]pyrazine-6-carboxylic acid;5-(4-fluorophenyl)-6-[methyl(propan-2-yl)amino]-[1,3]oxazolo[4,5-b]pyrazine-2-carboxylic acid;3-[methyl(propan-2-yl)amino]-2-naphthalen-2-ylfuro[2,3-b]pyrazine-6-carboxylic acid;3-[methyl(propan-2-yl)amino]-2-pyridin-3-ylfuro[2,3-b]pyrazine-6-carboxylic acid;3-morpholin-4-yl-2-propan-2-ylfuro[2,3-b]pyrazine-6-carboxylic acid;3-piperidin-1-yl-2-propan-2-ylfuro[2,3-b]pyrazine-6-carboxylic acid?
The canonical SMILES for 2-(1,3-benzodioxol-5-yl)-3-[methyl(propan-2-yl)amino]furo[2,3-b]pyrazine-6-carboxylic acid;2-(5-fluoro-1-benzofuran-2-yl)-3-[methyl(propan-2-yl)amino]furo[2,3-b]pyrazine-6-carboxylic acid;5-(4-fluorophenyl)-6-[methyl(propan-2-yl)amino]-[1,3]oxazolo[4,5-b]pyrazine-2-carboxylic acid;3-[methyl(propan-2-yl)amino]-2-naphthalen-2-ylfuro[2,3-b]pyrazine-6-carboxylic acid;3-[methyl(propan-2-yl)amino]-2-pyridin-3-ylfuro[2,3-b]pyrazine-6-carboxylic acid;3-morpholin-4-yl-2-propan-2-ylfuro[2,3-b]pyrazine-6-carboxylic acid;3-piperidin-1-yl-2-propan-2-ylfuro[2,3-b]pyrazine-6-carboxylic acid is CC(C)N(C)c1nc2oc(C(=O)O)cc2nc1-c1cc2cc(F)ccc2o1.CC(C)N(C)c1nc2oc(C(=O)O)cc2nc1-c1ccc2c(c1)OCO2.CC(C)N(C)c1nc2oc(C(=O)O)cc2nc1-c1ccc2ccccc2c1.CC(C)N(C)c1nc2oc(C(=O)O)cc2nc1-c1cccnc1.CC(C)N(C)c1nc2oc(C(=O)O)nc2nc1-c1ccc(F)cc1.CC(C)c1nc2cc(C(=O)O)oc2nc1N1CCCCC1.CC(C)c1nc2cc(C(=O)O)oc2nc1N1CCOCC1.
What is the InChIKey of 2-(1,3-benzodioxol-5-yl)-3-[methyl(propan-2-yl)amino]furo[2,3-b]pyrazine-6-carboxylic acid;2-(5-fluoro-1-benzofuran-2-yl)-3-[methyl(propan-2-yl)amino]furo[2,3-b]pyrazine-6-carboxylic acid;5-(4-fluorophenyl)-6-[methyl(propan-2-yl)amino]-[1,3]oxazolo[4,5-b]pyrazine-2-carboxylic acid;3-[methyl(propan-2-yl)amino]-2-naphthalen-2-ylfuro[2,3-b]pyrazine-6-carboxylic acid;3-[methyl(propan-2-yl)amino]-2-pyridin-3-ylfuro[2,3-b]pyrazine-6-carboxylic acid;3-morpholin-4-yl-2-propan-2-ylfuro[2,3-b]pyrazine-6-carboxylic acid;3-piperidin-1-yl-2-propan-2-ylfuro[2,3-b]pyrazine-6-carboxylic acid?
The InChIKey is LSHKPPNHYAGYBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19N3O3.C19H16FN3O4.C18H17N3O5.C16H15FN4O3.C16H16N4O3.C15H19N3O3.C14H17N3O4/c1-12(2)24(3)19-18(15-9-8-13-6-4-5-7-14(13)10-15)22-16-11-17(21(25)26)27-20(16)23-19;1-9(2)23(3)17-16(14-7-10-6-11(20)4-5-13(10)26-14)21-12-8-15(19(24)25)27-18(12)22-17;1-9(2)21(3)16-15(10-4-5-12-13(6-10)25-8-24-12)19-11-7-14(18(22)23)26-17(11)20-16;1-8(2)21(3)13-11(9-4-6-10(17)7-5-9)18-12-14(20-13)24-15(19-12)16(22)23;1-9(2)20(3)14-13(10-5-4-6-17-8-10)18-11-7-12(16(21)22)23-15(11)19-14;1-9(2)12-13(18-6-4-3-5-7-18)17-14-10(16-12)8-11(21-14)15(19)20;1-8(2)11-12(17-3-5-20-6-4-17)16-13-9(15-11)7-10(21-13)14(18)19/h4-12H,1-3H3,(H,25,26);4-9H,1-3H3,(H,24,25);4-7,9H,8H2,1-3H3,(H,22,23);4-8H,1-3H3,(H,22,23);4-9H,1-3H3,(H,21,22);8-9H,3-7H2,1-2H3,(H,19,20);7-8H,3-6H2,1-2H3,(H,18,19).
What are the key properties of 2-(1,3-benzodioxol-5-yl)-3-[methyl(propan-2-yl)amino]furo[2,3-b]pyrazine-6-carboxylic acid;2-(5-fluoro-1-benzofuran-2-yl)-3-[methyl(propan-2-yl)amino]furo[2,3-b]pyrazine-6-carboxylic acid;5-(4-fluorophenyl)-6-[methyl(propan-2-yl)amino]-[1,3]oxazolo[4,5-b]pyrazine-2-carboxylic acid;3-[methyl(propan-2-yl)amino]-2-naphthalen-2-ylfuro[2,3-b]pyrazine-6-carboxylic acid;3-[methyl(propan-2-yl)amino]-2-pyridin-3-ylfuro[2,3-b]pyrazine-6-carboxylic acid;3-morpholin-4-yl-2-propan-2-ylfuro[2,3-b]pyrazine-6-carboxylic acid;3-piperidin-1-yl-2-propan-2-ylfuro[2,3-b]pyrazine-6-carboxylic acid?
2-(1,3-benzodioxol-5-yl)-3-[methyl(propan-2-yl)amino]furo[2,3-b]pyrazine-6-carboxylic acid;2-(5-fluoro-1-benzofuran-2-yl)-3-[methyl(propan-2-yl)amino]furo[2,3-b]pyrazine-6-carboxylic acid;5-(4-fluorophenyl)-6-[methyl(propan-2-yl)amino]-[1,3]oxazolo[4,5-b]pyrazine-2-carboxylic acid;3-[methyl(propan-2-yl)amino]-2-naphthalen-2-ylfuro[2,3-b]pyrazine-6-carboxylic acid;3-[methyl(propan-2-yl)amino]-2-pyridin-3-ylfuro[2,3-b]pyrazine-6-carboxylic acid;3-morpholin-4-yl-2-propan-2-ylfuro[2,3-b]pyrazine-6-carboxylic acid;3-piperidin-1-yl-2-propan-2-ylfuro[2,3-b]pyrazine-6-carboxylic acid has a molecular weight of 2309.39 g/mol, XLogP of 22.77, 26 rotatable bonds, 7 hydrogen bond donors, and 41 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,3-benzodioxol-5-yl)-3-[methyl(propan-2-yl)amino]furo[2,3-b]pyrazine-6-carboxylic acid;2-(5-fluoro-1-benzofuran-2-yl)-3-[methyl(propan-2-yl)amino]furo[2,3-b]pyrazine-6-carboxylic acid;5-(4-fluorophenyl)-6-[methyl(propan-2-yl)amino]-[1,3]oxazolo[4,5-b]pyrazine-2-carboxylic acid;3-[methyl(propan-2-yl)amino]-2-naphthalen-2-ylfuro[2,3-b]pyrazine-6-carboxylic acid;3-[methyl(propan-2-yl)amino]-2-pyridin-3-ylfuro[2,3-b]pyrazine-6-carboxylic acid;3-morpholin-4-yl-2-propan-2-ylfuro[2,3-b]pyrazine-6-carboxylic acid;3-piperidin-1-yl-2-propan-2-ylfuro[2,3-b]pyrazine-6-carboxylic acid is sourced from PubChem (CID 159442100), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).