5-ethoxy-6-(4-methylsulfonylphenyl)-N-(thiophen-2-ylmethyl)pyrazin-2-amine;3-fluoro-N-(furan-3-ylmethyl)-6-(4-methylsulfonylphenyl)pyridin-2-amine;4-fluoro-N-(furan-3-ylmethyl)-6-(4-methylsulfonylphenyl)pyridin-2-amine;2-(furan-2-ylmethoxy)-6-(4-methylsulfonylphenyl)pyridine;5-methoxy-6-(4-methylsulfonylphenyl)-N-(thiophen-2-ylmethyl)pyrazin-2-amine;N-[(5-methylfuran-3-yl)methyl]-6-(4-methylsulfonylphenyl)pyridin-2-amine;2-(4-methylsulfonylphenyl)-6-[(5-methylthiophen-2-yl)methoxy]pyridine

C122H116F2N14O22S10 — CID 167555532

IUPAC5-ethoxy-6-(4-methylsulfonylphenyl)-N-(thiophen-2-ylmethyl)pyrazin-2-amine;3-fluoro-N-(furan-3-ylmethyl)-6-(4-methylsulfonylphenyl)pyridin-2-amine;4-fluoro-N-(furan-3-ylmethyl)-6-(4-methylsulfonylphenyl)pyridin-2-amine;2-(furan-2-ylmethoxy)-6-(4-methylsulfonylphenyl)pyridine;5-methoxy-6-(4-methylsulfonylphenyl)-N-(thiophen-2-ylmethyl)pyrazin-2-amine;N-[(5-methylfuran-3-yl)methyl]-6-(4-methylsulfonylphenyl)pyridin-2-amine;2-(4-methylsulfonylphenyl)-6-[(5-methylthiophen-2-yl)methoxy]pyridine
SMILESCCOc1ncc(NCc2cccs2)nc1-c1ccc(S(C)(=O)=O)cc1.COc1ncc(NCc2cccs2)nc1-c1ccc(S(C)(=O)=O)cc1.CS(=O)(=O)c1ccc(-c2cc(F)cc(NCc3ccoc3)n2)cc1.CS(=O)(=O)c1ccc(-c2ccc(F)c(NCc3ccoc3)n2)cc1.CS(=O)(=O)c1ccc(-c2cccc(OCc3ccco3)n2)cc1.Cc1cc(CNc2cccc(-c3ccc(S(C)(=O)=O)cc3)n2)co1.Cc1ccc(COc2cccc(-c3ccc(S(C)(=O)=O)cc3)n2)s1
InChIInChI=1S/C18H19N3O3S2.C18H18N2O3S.C18H17NO3S2.2C17H15FN2O3S.C17H17N3O3S2.C17H15NO4S/c1-3-24-18-17(13-6-8-15(9-7-13)26(2,22)23)21-16(12-20-18)19-11-14-5-4-10-25-14;1-13-10-14(12-23-13)11-19-18-5-3-4-17(20-18)15-6-8-16(9-7-15)24(2,21)22;1-13-6-9-15(23-13)12-22-18-5-3-4-17(19-18)14-7-10-16(11-8-14)24(2,20)21;1-24(21,22)15-4-2-13(3-5-15)16-8-14(18)9-17(20-16)19-10-12-6-7-23-11-12;1-24(21,22)14-4-2-13(3-5-14)16-7-6-15(18)17(20-16)19-10-12-8-9-23-11-12;1-23-17-16(12-5-7-14(8-6-12)25(2,21)22)20-15(11-19-17)18-10-13-4-3-9-24-13;1-23(19,20)15-9-7-13(8-10-15)16-5-2-6-17(18-16)22-12-14-4-3-11-21-14/h4-10,12H,3,11H2,1-2H3,(H,19,21);3-10,12H,11H2,1-2H3,(H,19,20);3-11H,12H2,1-2H3;2*2-9,11H,10H2,1H3,(H,19,20);3-9,11H,10H2,1-2H3,(H,18,20);2-11H,12H2,1H3
InChIKeyCYQRXEJPHMDIKL-UHFFFAOYSA-N
MW2489.01 g/mol
LogP24.93
Rot. Bonds38

About 5-ethoxy-6-(4-methylsulfonylphenyl)-N-(thiophen-2-ylmethyl)pyrazin-2-amine;3-fluoro-N-(furan-3-ylmethyl)-6-(4-methylsulfonylphenyl)pyridin-2-amine;4-fluoro-N-(furan-3-ylmethyl)-6-(4-methylsulfonylphenyl)pyridin-2-amine;2-(furan-2-ylmethoxy)-6-(4-methylsulfonylphenyl)pyridine;5-methoxy-6-(4-methylsulfonylphenyl)-N-(thiophen-2-ylmethyl)pyrazin-2-amine;N-[(5-methylfuran-3-yl)methyl]-6-(4-methylsulfonylphenyl)pyridin-2-amine;2-(4-methylsulfonylphenyl)-6-[(5-methylthiophen-2-yl)methoxy]pyridine

5-ethoxy-6-(4-methylsulfonylphenyl)-N-(thiophen-2-ylmethyl)pyrazin-2-amine;3-fluoro-N-(furan-3-ylmethyl)-6-(4-methylsulfonylphenyl)pyridin-2-amine;4-fluoro-N-(furan-3-ylmethyl)-6-(4-methylsulfonylphenyl)pyridin-2-amine;2-(furan-2-ylmethoxy)-6-(4-methylsulfonylphenyl)pyridine;5-methoxy-6-(4-methylsulfonylphenyl)-N-(thiophen-2-ylmethyl)pyrazin-2-amine;N-[(5-methylfuran-3-yl)methyl]-6-(4-methylsulfonylphenyl)pyridin-2-amine;2-(4-methylsulfonylphenyl)-6-[(5-methylthiophen-2-yl)methoxy]pyridine (PubChem CID 167555532) has the molecular formula C122H116F2N14O22S10 and a molecular weight of 2489.01 g/mol. Its IUPAC name is 5-ethoxy-6-(4-methylsulfonylphenyl)-N-(thiophen-2-ylmethyl)pyrazin-2-amine;3-fluoro-N-(furan-3-ylmethyl)-6-(4-methylsulfonylphenyl)pyridin-2-amine;4-fluoro-N-(furan-3-ylmethyl)-6-(4-methylsulfonylphenyl)pyridin-2-amine;2-(furan-2-ylmethoxy)-6-(4-methylsulfonylphenyl)pyridine;5-methoxy-6-(4-methylsulfonylphenyl)-N-(thiophen-2-ylmethyl)pyrazin-2-amine;N-[(5-methylfuran-3-yl)methyl]-6-(4-methylsulfonylphenyl)pyridin-2-amine;2-(4-methylsulfonylphenyl)-6-[(5-methylthiophen-2-yl)methoxy]pyridine.

Molecular Properties

Compound Name5-ethoxy-6-(4-methylsulfonylphenyl)-N-(thiophen-2-ylmethyl)pyrazin-2-amine;3-fluoro-N-(furan-3-ylmethyl)-6-(4-methylsulfonylphenyl)pyridin-2-amine;4-fluoro-N-(furan-3-ylmethyl)-6-(4-methylsulfonylphenyl)pyridin-2-amine;2-(furan-2-ylmethoxy)-6-(4-methylsulfonylphenyl)pyridine;5-methoxy-6-(4-methylsulfonylphenyl)-N-(thiophen-2-ylmethyl)pyrazin-2-amine;N-[(5-methylfuran-3-yl)methyl]-6-(4-methylsulfonylphenyl)pyridin-2-amine;2-(4-methylsulfonylphenyl)-6-[(5-methylthiophen-2-yl)methoxy]pyridine
PubChem CID167555532
Molecular FormulaC122H116F2N14O22S10
Molecular Weight2489.01 g/mol
Exact Mass2486.56
IUPAC Name5-ethoxy-6-(4-methylsulfonylphenyl)-N-(thiophen-2-ylmethyl)pyrazin-2-amine;3-fluoro-N-(furan-3-ylmethyl)-6-(4-methylsulfonylphenyl)pyridin-2-amine;4-fluoro-N-(furan-3-ylmethyl)-6-(4-methylsulfonylphenyl)pyridin-2-amine;2-(furan-2-ylmethoxy)-6-(4-methylsulfonylphenyl)pyridine;5-methoxy-6-(4-methylsulfonylphenyl)-N-(thiophen-2-ylmethyl)pyrazin-2-amine;N-[(5-methylfuran-3-yl)methyl]-6-(4-methylsulfonylphenyl)pyridin-2-amine;2-(4-methylsulfonylphenyl)-6-[(5-methylthiophen-2-yl)methoxy]pyridine
SMILESCCOc1ncc(NCc2cccs2)nc1-c1ccc(S(C)(=O)=O)cc1.COc1ncc(NCc2cccs2)nc1-c1ccc(S(C)(=O)=O)cc1.CS(=O)(=O)c1ccc(-c2cc(F)cc(NCc3ccoc3)n2)cc1.CS(=O)(=O)c1ccc(-c2ccc(F)c(NCc3ccoc3)n2)cc1.CS(=O)(=O)c1ccc(-c2cccc(OCc3ccco3)n2)cc1.Cc1cc(CNc2cccc(-c3ccc(S(C)(=O)=O)cc3)n2)co1.Cc1ccc(COc2cccc(-c3ccc(S(C)(=O)=O)cc3)n2)s1
InChIInChI=1S/C18H19N3O3S2.C18H18N2O3S.C18H17NO3S2.2C17H15FN2O3S.C17H17N3O3S2.C17H15NO4S/c1-3-24-18-17(13-6-8-15(9-7-13)26(2,22)23)21-16(12-20-18)19-11-14-5-4-10-25-14;1-13-10-14(12-23-13)11-19-18-5-3-4-17(20-18)15-6-8-16(9-7-15)24(2,21)22;1-13-6-9-15(23-13)12-22-18-5-3-4-17(19-18)14-7-10-16(11-8-14)24(2,20)21;1-24(21,22)15-4-2-13(3-5-15)16-8-14(18)9-17(20-16)19-10-12-6-7-23-11-12;1-24(21,22)14-4-2-13(3-5-14)16-7-6-15(18)17(20-16)19-10-12-8-9-23-11-12;1-23-17-16(12-5-7-14(8-6-12)25(2,21)22)20-15(11-19-17)18-10-13-4-3-9-24-13;1-23(19,20)15-9-7-13(8-10-15)16-5-2-6-17(18-16)22-12-14-4-3-11-21-14/h4-10,12H,3,11H2,1-2H3,(H,19,21);3-10,12H,11H2,1-2H3,(H,19,20);3-11H,12H2,1-2H3;2*2-9,11H,10H2,1H3,(H,19,20);3-9,11H,10H2,1-2H3,(H,18,20);2-11H,12H2,1H3
InChIKeyCYQRXEJPHMDIKL-UHFFFAOYSA-N
XLogP24.93
TPSA504.62 Ų
H-Bond Donors5
H-Bond Acceptors39
Rotatable Bonds38
Heavy Atoms170
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002489.01
LogP ≤ 524.93
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1039

Analyze 5-ethoxy-6-(4-methylsulfonylphenyl)-N-(thiophen-2-ylmethyl)pyrazin-2-amine;3-fluoro-N-(furan-3-ylmethyl)-6-(4-methylsulfonylphenyl)pyridin-2-amine;4-fluoro-N-(furan-3-ylmethyl)-6-(4-methylsulfonylphenyl)pyridin-2-amine;2-(furan-2-ylmethoxy)-6-(4-methylsulfonylphenyl)pyridine;5-methoxy-6-(4-methylsulfonylphenyl)-N-(thiophen-2-ylmethyl)pyrazin-2-amine;N-[(5-methylfuran-3-yl)methyl]-6-(4-methylsulfonylphenyl)pyridin-2-amine;2-(4-methylsulfonylphenyl)-6-[(5-methylthiophen-2-yl)methoxy]pyridine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 5-ethoxy-6-(4-methylsulfonylphenyl)-N-(thiophen-2-ylmethyl)pyrazin-2-amine;3-fluoro-N-(furan-3-ylmethyl)-6-(4-methylsulfonylphenyl)pyridin-2-amine;4-fluoro-N-(furan-3-ylmethyl)-6-(4-methylsulfonylphenyl)pyridin-2-amine;2-(furan-2-ylmethoxy)-6-(4-methylsulfonylphenyl)pyridine;5-methoxy-6-(4-methylsulfonylphenyl)-N-(thiophen-2-ylmethyl)pyrazin-2-amine;N-[(5-methylfuran-3-yl)methyl]-6-(4-methylsulfonylphenyl)pyridin-2-amine;2-(4-methylsulfonylphenyl)-6-[(5-methylthiophen-2-yl)methoxy]pyridine?
The IUPAC name of 5-ethoxy-6-(4-methylsulfonylphenyl)-N-(thiophen-2-ylmethyl)pyrazin-2-amine;3-fluoro-N-(furan-3-ylmethyl)-6-(4-methylsulfonylphenyl)pyridin-2-amine;4-fluoro-N-(furan-3-ylmethyl)-6-(4-methylsulfonylphenyl)pyridin-2-amine;2-(furan-2-ylmethoxy)-6-(4-methylsulfonylphenyl)pyridine;5-methoxy-6-(4-methylsulfonylphenyl)-N-(thiophen-2-ylmethyl)pyrazin-2-amine;N-[(5-methylfuran-3-yl)methyl]-6-(4-methylsulfonylphenyl)pyridin-2-amine;2-(4-methylsulfonylphenyl)-6-[(5-methylthiophen-2-yl)methoxy]pyridine (CID 167555532) is 5-ethoxy-6-(4-methylsulfonylphenyl)-N-(thiophen-2-ylmethyl)pyrazin-2-amine;3-fluoro-N-(furan-3-ylmethyl)-6-(4-methylsulfonylphenyl)pyridin-2-amine;4-fluoro-N-(furan-3-ylmethyl)-6-(4-methylsulfonylphenyl)pyridin-2-amine;2-(furan-2-ylmethoxy)-6-(4-methylsulfonylphenyl)pyridine;5-methoxy-6-(4-methylsulfonylphenyl)-N-(thiophen-2-ylmethyl)pyrazin-2-amine;N-[(5-methylfuran-3-yl)methyl]-6-(4-methylsulfonylphenyl)pyridin-2-amine;2-(4-methylsulfonylphenyl)-6-[(5-methylthiophen-2-yl)methoxy]pyridine.
What is the SMILES notation for 5-ethoxy-6-(4-methylsulfonylphenyl)-N-(thiophen-2-ylmethyl)pyrazin-2-amine;3-fluoro-N-(furan-3-ylmethyl)-6-(4-methylsulfonylphenyl)pyridin-2-amine;4-fluoro-N-(furan-3-ylmethyl)-6-(4-methylsulfonylphenyl)pyridin-2-amine;2-(furan-2-ylmethoxy)-6-(4-methylsulfonylphenyl)pyridine;5-methoxy-6-(4-methylsulfonylphenyl)-N-(thiophen-2-ylmethyl)pyrazin-2-amine;N-[(5-methylfuran-3-yl)methyl]-6-(4-methylsulfonylphenyl)pyridin-2-amine;2-(4-methylsulfonylphenyl)-6-[(5-methylthiophen-2-yl)methoxy]pyridine?
The canonical SMILES for 5-ethoxy-6-(4-methylsulfonylphenyl)-N-(thiophen-2-ylmethyl)pyrazin-2-amine;3-fluoro-N-(furan-3-ylmethyl)-6-(4-methylsulfonylphenyl)pyridin-2-amine;4-fluoro-N-(furan-3-ylmethyl)-6-(4-methylsulfonylphenyl)pyridin-2-amine;2-(furan-2-ylmethoxy)-6-(4-methylsulfonylphenyl)pyridine;5-methoxy-6-(4-methylsulfonylphenyl)-N-(thiophen-2-ylmethyl)pyrazin-2-amine;N-[(5-methylfuran-3-yl)methyl]-6-(4-methylsulfonylphenyl)pyridin-2-amine;2-(4-methylsulfonylphenyl)-6-[(5-methylthiophen-2-yl)methoxy]pyridine is CCOc1ncc(NCc2cccs2)nc1-c1ccc(S(C)(=O)=O)cc1.COc1ncc(NCc2cccs2)nc1-c1ccc(S(C)(=O)=O)cc1.CS(=O)(=O)c1ccc(-c2cc(F)cc(NCc3ccoc3)n2)cc1.CS(=O)(=O)c1ccc(-c2ccc(F)c(NCc3ccoc3)n2)cc1.CS(=O)(=O)c1ccc(-c2cccc(OCc3ccco3)n2)cc1.Cc1cc(CNc2cccc(-c3ccc(S(C)(=O)=O)cc3)n2)co1.Cc1ccc(COc2cccc(-c3ccc(S(C)(=O)=O)cc3)n2)s1.
What is the InChIKey of 5-ethoxy-6-(4-methylsulfonylphenyl)-N-(thiophen-2-ylmethyl)pyrazin-2-amine;3-fluoro-N-(furan-3-ylmethyl)-6-(4-methylsulfonylphenyl)pyridin-2-amine;4-fluoro-N-(furan-3-ylmethyl)-6-(4-methylsulfonylphenyl)pyridin-2-amine;2-(furan-2-ylmethoxy)-6-(4-methylsulfonylphenyl)pyridine;5-methoxy-6-(4-methylsulfonylphenyl)-N-(thiophen-2-ylmethyl)pyrazin-2-amine;N-[(5-methylfuran-3-yl)methyl]-6-(4-methylsulfonylphenyl)pyridin-2-amine;2-(4-methylsulfonylphenyl)-6-[(5-methylthiophen-2-yl)methoxy]pyridine?
The InChIKey is CYQRXEJPHMDIKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N3O3S2.C18H18N2O3S.C18H17NO3S2.2C17H15FN2O3S.C17H17N3O3S2.C17H15NO4S/c1-3-24-18-17(13-6-8-15(9-7-13)26(2,22)23)21-16(12-20-18)19-11-14-5-4-10-25-14;1-13-10-14(12-23-13)11-19-18-5-3-4-17(20-18)15-6-8-16(9-7-15)24(2,21)22;1-13-6-9-15(23-13)12-22-18-5-3-4-17(19-18)14-7-10-16(11-8-14)24(2,20)21;1-24(21,22)15-4-2-13(3-5-15)16-8-14(18)9-17(20-16)19-10-12-6-7-23-11-12;1-24(21,22)14-4-2-13(3-5-14)16-7-6-15(18)17(20-16)19-10-12-8-9-23-11-12;1-23-17-16(12-5-7-14(8-6-12)25(2,21)22)20-15(11-19-17)18-10-13-4-3-9-24-13;1-23(19,20)15-9-7-13(8-10-15)16-5-2-6-17(18-16)22-12-14-4-3-11-21-14/h4-10,12H,3,11H2,1-2H3,(H,19,21);3-10,12H,11H2,1-2H3,(H,19,20);3-11H,12H2,1-2H3;2*2-9,11H,10H2,1H3,(H,19,20);3-9,11H,10H2,1-2H3,(H,18,20);2-11H,12H2,1H3.
What are the key properties of 5-ethoxy-6-(4-methylsulfonylphenyl)-N-(thiophen-2-ylmethyl)pyrazin-2-amine;3-fluoro-N-(furan-3-ylmethyl)-6-(4-methylsulfonylphenyl)pyridin-2-amine;4-fluoro-N-(furan-3-ylmethyl)-6-(4-methylsulfonylphenyl)pyridin-2-amine;2-(furan-2-ylmethoxy)-6-(4-methylsulfonylphenyl)pyridine;5-methoxy-6-(4-methylsulfonylphenyl)-N-(thiophen-2-ylmethyl)pyrazin-2-amine;N-[(5-methylfuran-3-yl)methyl]-6-(4-methylsulfonylphenyl)pyridin-2-amine;2-(4-methylsulfonylphenyl)-6-[(5-methylthiophen-2-yl)methoxy]pyridine?
5-ethoxy-6-(4-methylsulfonylphenyl)-N-(thiophen-2-ylmethyl)pyrazin-2-amine;3-fluoro-N-(furan-3-ylmethyl)-6-(4-methylsulfonylphenyl)pyridin-2-amine;4-fluoro-N-(furan-3-ylmethyl)-6-(4-methylsulfonylphenyl)pyridin-2-amine;2-(furan-2-ylmethoxy)-6-(4-methylsulfonylphenyl)pyridine;5-methoxy-6-(4-methylsulfonylphenyl)-N-(thiophen-2-ylmethyl)pyrazin-2-amine;N-[(5-methylfuran-3-yl)methyl]-6-(4-methylsulfonylphenyl)pyridin-2-amine;2-(4-methylsulfonylphenyl)-6-[(5-methylthiophen-2-yl)methoxy]pyridine has a molecular weight of 2489.01 g/mol, XLogP of 24.93, 38 rotatable bonds, 5 hydrogen bond donors, and 39 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethoxy-6-(4-methylsulfonylphenyl)-N-(thiophen-2-ylmethyl)pyrazin-2-amine;3-fluoro-N-(furan-3-ylmethyl)-6-(4-methylsulfonylphenyl)pyridin-2-amine;4-fluoro-N-(furan-3-ylmethyl)-6-(4-methylsulfonylphenyl)pyridin-2-amine;2-(furan-2-ylmethoxy)-6-(4-methylsulfonylphenyl)pyridine;5-methoxy-6-(4-methylsulfonylphenyl)-N-(thiophen-2-ylmethyl)pyrazin-2-amine;N-[(5-methylfuran-3-yl)methyl]-6-(4-methylsulfonylphenyl)pyridin-2-amine;2-(4-methylsulfonylphenyl)-6-[(5-methylthiophen-2-yl)methoxy]pyridine is sourced from PubChem (CID 167555532), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).