2-(furan-3-ylmethoxy)-6-(4-methylsulfonylphenyl)pyrazine;N-(furan-3-ylmethyl)-N-methyl-6-(4-methylsulfonylphenyl)pyridin-2-amine;5-methoxy-6-(4-methylsulfonylphenyl)-N-[(3-methylthiophen-2-yl)methyl]pyrazin-2-amine;5-methoxy-6-(6-methylsulfonyl-3-pyridinyl)-N-(thiophen-2-ylmethyl)pyrazin-2-amine;2-(4-methylsulfonylphenyl)-6-[(Z)-2-thiophen-2-ylethenyl]pyrazine;2-(4-methylsulfonylphenyl)-6-[(1S)-1-thiophen-2-ylethoxy]pyrazine;6-(6-methylsulfonyl-3-pyridinyl)-N-(thiophen-2-ylmethyl)pyridin-2-amine

C118H112N18O20S12 — CID 167564561

IUPAC2-(furan-3-ylmethoxy)-6-(4-methylsulfonylphenyl)pyrazine;N-(furan-3-ylmethyl)-N-methyl-6-(4-methylsulfonylphenyl)pyridin-2-amine;5-methoxy-6-(4-methylsulfonylphenyl)-N-[(3-methylthiophen-2-yl)methyl]pyrazin-2-amine;5-methoxy-6-(6-methylsulfonyl-3-pyridinyl)-N-(thiophen-2-ylmethyl)pyrazin-2-amine;2-(4-methylsulfonylphenyl)-6-[(Z)-2-thiophen-2-ylethenyl]pyrazine;2-(4-methylsulfonylphenyl)-6-[(1S)-1-thiophen-2-ylethoxy]pyrazine;6-(6-methylsulfonyl-3-pyridinyl)-N-(thiophen-2-ylmethyl)pyridin-2-amine
SMILESCN(Cc1ccoc1)c1cccc(-c2ccc(S(C)(=O)=O)cc2)n1.COc1ncc(NCc2cccs2)nc1-c1ccc(S(C)(=O)=O)nc1.COc1ncc(NCc2sccc2C)nc1-c1ccc(S(C)(=O)=O)cc1.CS(=O)(=O)c1ccc(-c2cccc(NCc3cccs3)n2)cn1.CS(=O)(=O)c1ccc(-c2cncc(/C=C\c3cccs3)n2)cc1.CS(=O)(=O)c1ccc(-c2cncc(OCc3ccoc3)n2)cc1.C[C@H](Oc1cncc(-c2ccc(S(C)(=O)=O)cc2)n1)c1cccs1
InChIInChI=1S/C18H19N3O3S2.C18H18N2O3S.C17H16N2O3S2.C17H14N2O2S2.C16H16N4O3S2.C16H15N3O2S2.C16H14N2O4S/c1-12-8-9-25-15(12)10-19-16-11-20-18(24-2)17(21-16)13-4-6-14(7-5-13)26(3,22)23;1-20(12-14-10-11-23-13-14)18-5-3-4-17(19-18)15-6-8-16(9-7-15)24(2,21)22;1-12(16-4-3-9-23-16)22-17-11-18-10-15(19-17)13-5-7-14(8-6-13)24(2,20)21;1-23(20,21)16-8-4-13(5-9-16)17-12-18-11-14(19-17)6-7-15-3-2-10-22-15;1-23-16-15(11-5-6-14(18-8-11)25(2,21)22)20-13(10-19-16)17-9-12-4-3-7-24-12;1-23(20,21)16-8-7-12(10-18-16)14-5-2-6-15(19-14)17-11-13-4-3-9-22-13;1-23(19,20)14-4-2-13(3-5-14)15-8-17-9-16(18-15)22-11-12-6-7-21-10-12/h4-9,11H,10H2,1-3H3,(H,19,21);3-11,13H,12H2,1-2H3;3-12H,1-2H3;2-12H,1H3;3-8,10H,9H2,1-2H3,(H,17,20);2-10H,11H2,1H3,(H,17,19);2-10H,11H2,1H3/b;;;7-6-;;;/t;;12-;;;;/m..0..../s1
InChIKeyFCLYTQSFODOUIO-HIPQBBLYSA-N
MW2487.10 g/mol
LogP23.01
Rot. Bonds36

About 2-(furan-3-ylmethoxy)-6-(4-methylsulfonylphenyl)pyrazine;N-(furan-3-ylmethyl)-N-methyl-6-(4-methylsulfonylphenyl)pyridin-2-amine;5-methoxy-6-(4-methylsulfonylphenyl)-N-[(3-methylthiophen-2-yl)methyl]pyrazin-2-amine;5-methoxy-6-(6-methylsulfonyl-3-pyridinyl)-N-(thiophen-2-ylmethyl)pyrazin-2-amine;2-(4-methylsulfonylphenyl)-6-[(Z)-2-thiophen-2-ylethenyl]pyrazine;2-(4-methylsulfonylphenyl)-6-[(1S)-1-thiophen-2-ylethoxy]pyrazine;6-(6-methylsulfonyl-3-pyridinyl)-N-(thiophen-2-ylmethyl)pyridin-2-amine

2-(furan-3-ylmethoxy)-6-(4-methylsulfonylphenyl)pyrazine;N-(furan-3-ylmethyl)-N-methyl-6-(4-methylsulfonylphenyl)pyridin-2-amine;5-methoxy-6-(4-methylsulfonylphenyl)-N-[(3-methylthiophen-2-yl)methyl]pyrazin-2-amine;5-methoxy-6-(6-methylsulfonyl-3-pyridinyl)-N-(thiophen-2-ylmethyl)pyrazin-2-amine;2-(4-methylsulfonylphenyl)-6-[(Z)-2-thiophen-2-ylethenyl]pyrazine;2-(4-methylsulfonylphenyl)-6-[(1S)-1-thiophen-2-ylethoxy]pyrazine;6-(6-methylsulfonyl-3-pyridinyl)-N-(thiophen-2-ylmethyl)pyridin-2-amine (PubChem CID 167564561) has the molecular formula C118H112N18O20S12 and a molecular weight of 2487.10 g/mol. Its IUPAC name is 2-(furan-3-ylmethoxy)-6-(4-methylsulfonylphenyl)pyrazine;N-(furan-3-ylmethyl)-N-methyl-6-(4-methylsulfonylphenyl)pyridin-2-amine;5-methoxy-6-(4-methylsulfonylphenyl)-N-[(3-methylthiophen-2-yl)methyl]pyrazin-2-amine;5-methoxy-6-(6-methylsulfonyl-3-pyridinyl)-N-(thiophen-2-ylmethyl)pyrazin-2-amine;2-(4-methylsulfonylphenyl)-6-[(Z)-2-thiophen-2-ylethenyl]pyrazine;2-(4-methylsulfonylphenyl)-6-[(1S)-1-thiophen-2-ylethoxy]pyrazine;6-(6-methylsulfonyl-3-pyridinyl)-N-(thiophen-2-ylmethyl)pyridin-2-amine.

Molecular Properties

Compound Name2-(furan-3-ylmethoxy)-6-(4-methylsulfonylphenyl)pyrazine;N-(furan-3-ylmethyl)-N-methyl-6-(4-methylsulfonylphenyl)pyridin-2-amine;5-methoxy-6-(4-methylsulfonylphenyl)-N-[(3-methylthiophen-2-yl)methyl]pyrazin-2-amine;5-methoxy-6-(6-methylsulfonyl-3-pyridinyl)-N-(thiophen-2-ylmethyl)pyrazin-2-amine;2-(4-methylsulfonylphenyl)-6-[(Z)-2-thiophen-2-ylethenyl]pyrazine;2-(4-methylsulfonylphenyl)-6-[(1S)-1-thiophen-2-ylethoxy]pyrazine;6-(6-methylsulfonyl-3-pyridinyl)-N-(thiophen-2-ylmethyl)pyridin-2-amine
PubChem CID167564561
Molecular FormulaC118H112N18O20S12
Molecular Weight2487.10 g/mol
Exact Mass2484.49
IUPAC Name2-(furan-3-ylmethoxy)-6-(4-methylsulfonylphenyl)pyrazine;N-(furan-3-ylmethyl)-N-methyl-6-(4-methylsulfonylphenyl)pyridin-2-amine;5-methoxy-6-(4-methylsulfonylphenyl)-N-[(3-methylthiophen-2-yl)methyl]pyrazin-2-amine;5-methoxy-6-(6-methylsulfonyl-3-pyridinyl)-N-(thiophen-2-ylmethyl)pyrazin-2-amine;2-(4-methylsulfonylphenyl)-6-[(Z)-2-thiophen-2-ylethenyl]pyrazine;2-(4-methylsulfonylphenyl)-6-[(1S)-1-thiophen-2-ylethoxy]pyrazine;6-(6-methylsulfonyl-3-pyridinyl)-N-(thiophen-2-ylmethyl)pyridin-2-amine
SMILESCN(Cc1ccoc1)c1cccc(-c2ccc(S(C)(=O)=O)cc2)n1.COc1ncc(NCc2cccs2)nc1-c1ccc(S(C)(=O)=O)nc1.COc1ncc(NCc2sccc2C)nc1-c1ccc(S(C)(=O)=O)cc1.CS(=O)(=O)c1ccc(-c2cccc(NCc3cccs3)n2)cn1.CS(=O)(=O)c1ccc(-c2cncc(/C=C\c3cccs3)n2)cc1.CS(=O)(=O)c1ccc(-c2cncc(OCc3ccoc3)n2)cc1.C[C@H](Oc1cncc(-c2ccc(S(C)(=O)=O)cc2)n1)c1cccs1
InChIInChI=1S/C18H19N3O3S2.C18H18N2O3S.C17H16N2O3S2.C17H14N2O2S2.C16H16N4O3S2.C16H15N3O2S2.C16H14N2O4S/c1-12-8-9-25-15(12)10-19-16-11-20-18(24-2)17(21-16)13-4-6-14(7-5-13)26(3,22)23;1-20(12-14-10-11-23-13-14)18-5-3-4-17(19-18)15-6-8-16(9-7-15)24(2,21)22;1-12(16-4-3-9-23-16)22-17-11-18-10-15(19-17)13-5-7-14(8-6-13)24(2,20)21;1-23(20,21)16-8-4-13(5-9-16)17-12-18-11-14(19-17)6-7-15-3-2-10-22-15;1-23-16-15(11-5-6-14(18-8-11)25(2,21)22)20-13(10-19-16)17-9-12-4-3-7-24-12;1-23(20,21)16-8-7-12(10-18-16)14-5-2-6-15(19-14)17-11-13-4-3-9-22-13;1-23(19,20)14-4-2-13(3-5-14)15-8-17-9-16(18-15)22-11-12-6-7-21-10-12/h4-9,11H,10H2,1-3H3,(H,19,21);3-11,13H,12H2,1-2H3;3-12H,1-2H3;2-12H,1H3;3-8,10H,9H2,1-2H3,(H,17,20);2-10H,11H2,1H3,(H,17,19);2-10H,11H2,1H3/b;;;7-6-;;;/t;;12-;;;;/m..0..../s1
InChIKeyFCLYTQSFODOUIO-HIPQBBLYSA-N
XLogP23.01
TPSA521.97 Ų
H-Bond Donors3
H-Bond Acceptors43
Rotatable Bonds36
Heavy Atoms168
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002487.10
LogP ≤ 523.01
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 1043

Analyze 2-(furan-3-ylmethoxy)-6-(4-methylsulfonylphenyl)pyrazine;N-(furan-3-ylmethyl)-N-methyl-6-(4-methylsulfonylphenyl)pyridin-2-amine;5-methoxy-6-(4-methylsulfonylphenyl)-N-[(3-methylthiophen-2-yl)methyl]pyrazin-2-amine;5-methoxy-6-(6-methylsulfonyl-3-pyridinyl)-N-(thiophen-2-ylmethyl)pyrazin-2-amine;2-(4-methylsulfonylphenyl)-6-[(Z)-2-thiophen-2-ylethenyl]pyrazine;2-(4-methylsulfonylphenyl)-6-[(1S)-1-thiophen-2-ylethoxy]pyrazine;6-(6-methylsulfonyl-3-pyridinyl)-N-(thiophen-2-ylmethyl)pyridin-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Frequently Asked Questions

What is the IUPAC name of 2-(furan-3-ylmethoxy)-6-(4-methylsulfonylphenyl)pyrazine;N-(furan-3-ylmethyl)-N-methyl-6-(4-methylsulfonylphenyl)pyridin-2-amine;5-methoxy-6-(4-methylsulfonylphenyl)-N-[(3-methylthiophen-2-yl)methyl]pyrazin-2-amine;5-methoxy-6-(6-methylsulfonyl-3-pyridinyl)-N-(thiophen-2-ylmethyl)pyrazin-2-amine;2-(4-methylsulfonylphenyl)-6-[(Z)-2-thiophen-2-ylethenyl]pyrazine;2-(4-methylsulfonylphenyl)-6-[(1S)-1-thiophen-2-ylethoxy]pyrazine;6-(6-methylsulfonyl-3-pyridinyl)-N-(thiophen-2-ylmethyl)pyridin-2-amine?
The IUPAC name of 2-(furan-3-ylmethoxy)-6-(4-methylsulfonylphenyl)pyrazine;N-(furan-3-ylmethyl)-N-methyl-6-(4-methylsulfonylphenyl)pyridin-2-amine;5-methoxy-6-(4-methylsulfonylphenyl)-N-[(3-methylthiophen-2-yl)methyl]pyrazin-2-amine;5-methoxy-6-(6-methylsulfonyl-3-pyridinyl)-N-(thiophen-2-ylmethyl)pyrazin-2-amine;2-(4-methylsulfonylphenyl)-6-[(Z)-2-thiophen-2-ylethenyl]pyrazine;2-(4-methylsulfonylphenyl)-6-[(1S)-1-thiophen-2-ylethoxy]pyrazine;6-(6-methylsulfonyl-3-pyridinyl)-N-(thiophen-2-ylmethyl)pyridin-2-amine (CID 167564561) is 2-(furan-3-ylmethoxy)-6-(4-methylsulfonylphenyl)pyrazine;N-(furan-3-ylmethyl)-N-methyl-6-(4-methylsulfonylphenyl)pyridin-2-amine;5-methoxy-6-(4-methylsulfonylphenyl)-N-[(3-methylthiophen-2-yl)methyl]pyrazin-2-amine;5-methoxy-6-(6-methylsulfonyl-3-pyridinyl)-N-(thiophen-2-ylmethyl)pyrazin-2-amine;2-(4-methylsulfonylphenyl)-6-[(Z)-2-thiophen-2-ylethenyl]pyrazine;2-(4-methylsulfonylphenyl)-6-[(1S)-1-thiophen-2-ylethoxy]pyrazine;6-(6-methylsulfonyl-3-pyridinyl)-N-(thiophen-2-ylmethyl)pyridin-2-amine.
What is the SMILES notation for 2-(furan-3-ylmethoxy)-6-(4-methylsulfonylphenyl)pyrazine;N-(furan-3-ylmethyl)-N-methyl-6-(4-methylsulfonylphenyl)pyridin-2-amine;5-methoxy-6-(4-methylsulfonylphenyl)-N-[(3-methylthiophen-2-yl)methyl]pyrazin-2-amine;5-methoxy-6-(6-methylsulfonyl-3-pyridinyl)-N-(thiophen-2-ylmethyl)pyrazin-2-amine;2-(4-methylsulfonylphenyl)-6-[(Z)-2-thiophen-2-ylethenyl]pyrazine;2-(4-methylsulfonylphenyl)-6-[(1S)-1-thiophen-2-ylethoxy]pyrazine;6-(6-methylsulfonyl-3-pyridinyl)-N-(thiophen-2-ylmethyl)pyridin-2-amine?
The canonical SMILES for 2-(furan-3-ylmethoxy)-6-(4-methylsulfonylphenyl)pyrazine;N-(furan-3-ylmethyl)-N-methyl-6-(4-methylsulfonylphenyl)pyridin-2-amine;5-methoxy-6-(4-methylsulfonylphenyl)-N-[(3-methylthiophen-2-yl)methyl]pyrazin-2-amine;5-methoxy-6-(6-methylsulfonyl-3-pyridinyl)-N-(thiophen-2-ylmethyl)pyrazin-2-amine;2-(4-methylsulfonylphenyl)-6-[(Z)-2-thiophen-2-ylethenyl]pyrazine;2-(4-methylsulfonylphenyl)-6-[(1S)-1-thiophen-2-ylethoxy]pyrazine;6-(6-methylsulfonyl-3-pyridinyl)-N-(thiophen-2-ylmethyl)pyridin-2-amine is CN(Cc1ccoc1)c1cccc(-c2ccc(S(C)(=O)=O)cc2)n1.COc1ncc(NCc2cccs2)nc1-c1ccc(S(C)(=O)=O)nc1.COc1ncc(NCc2sccc2C)nc1-c1ccc(S(C)(=O)=O)cc1.CS(=O)(=O)c1ccc(-c2cccc(NCc3cccs3)n2)cn1.CS(=O)(=O)c1ccc(-c2cncc(/C=C\c3cccs3)n2)cc1.CS(=O)(=O)c1ccc(-c2cncc(OCc3ccoc3)n2)cc1.C[C@H](Oc1cncc(-c2ccc(S(C)(=O)=O)cc2)n1)c1cccs1.
What is the InChIKey of 2-(furan-3-ylmethoxy)-6-(4-methylsulfonylphenyl)pyrazine;N-(furan-3-ylmethyl)-N-methyl-6-(4-methylsulfonylphenyl)pyridin-2-amine;5-methoxy-6-(4-methylsulfonylphenyl)-N-[(3-methylthiophen-2-yl)methyl]pyrazin-2-amine;5-methoxy-6-(6-methylsulfonyl-3-pyridinyl)-N-(thiophen-2-ylmethyl)pyrazin-2-amine;2-(4-methylsulfonylphenyl)-6-[(Z)-2-thiophen-2-ylethenyl]pyrazine;2-(4-methylsulfonylphenyl)-6-[(1S)-1-thiophen-2-ylethoxy]pyrazine;6-(6-methylsulfonyl-3-pyridinyl)-N-(thiophen-2-ylmethyl)pyridin-2-amine?
The InChIKey is FCLYTQSFODOUIO-HIPQBBLYSA-N. The full InChI is InChI=1S/C18H19N3O3S2.C18H18N2O3S.C17H16N2O3S2.C17H14N2O2S2.C16H16N4O3S2.C16H15N3O2S2.C16H14N2O4S/c1-12-8-9-25-15(12)10-19-16-11-20-18(24-2)17(21-16)13-4-6-14(7-5-13)26(3,22)23;1-20(12-14-10-11-23-13-14)18-5-3-4-17(19-18)15-6-8-16(9-7-15)24(2,21)22;1-12(16-4-3-9-23-16)22-17-11-18-10-15(19-17)13-5-7-14(8-6-13)24(2,20)21;1-23(20,21)16-8-4-13(5-9-16)17-12-18-11-14(19-17)6-7-15-3-2-10-22-15;1-23-16-15(11-5-6-14(18-8-11)25(2,21)22)20-13(10-19-16)17-9-12-4-3-7-24-12;1-23(20,21)16-8-7-12(10-18-16)14-5-2-6-15(19-14)17-11-13-4-3-9-22-13;1-23(19,20)14-4-2-13(3-5-14)15-8-17-9-16(18-15)22-11-12-6-7-21-10-12/h4-9,11H,10H2,1-3H3,(H,19,21);3-11,13H,12H2,1-2H3;3-12H,1-2H3;2-12H,1H3;3-8,10H,9H2,1-2H3,(H,17,20);2-10H,11H2,1H3,(H,17,19);2-10H,11H2,1H3/b;;;7-6-;;;/t;;12-;;;;/m..0..../s1.
What are the key properties of 2-(furan-3-ylmethoxy)-6-(4-methylsulfonylphenyl)pyrazine;N-(furan-3-ylmethyl)-N-methyl-6-(4-methylsulfonylphenyl)pyridin-2-amine;5-methoxy-6-(4-methylsulfonylphenyl)-N-[(3-methylthiophen-2-yl)methyl]pyrazin-2-amine;5-methoxy-6-(6-methylsulfonyl-3-pyridinyl)-N-(thiophen-2-ylmethyl)pyrazin-2-amine;2-(4-methylsulfonylphenyl)-6-[(Z)-2-thiophen-2-ylethenyl]pyrazine;2-(4-methylsulfonylphenyl)-6-[(1S)-1-thiophen-2-ylethoxy]pyrazine;6-(6-methylsulfonyl-3-pyridinyl)-N-(thiophen-2-ylmethyl)pyridin-2-amine?
2-(furan-3-ylmethoxy)-6-(4-methylsulfonylphenyl)pyrazine;N-(furan-3-ylmethyl)-N-methyl-6-(4-methylsulfonylphenyl)pyridin-2-amine;5-methoxy-6-(4-methylsulfonylphenyl)-N-[(3-methylthiophen-2-yl)methyl]pyrazin-2-amine;5-methoxy-6-(6-methylsulfonyl-3-pyridinyl)-N-(thiophen-2-ylmethyl)pyrazin-2-amine;2-(4-methylsulfonylphenyl)-6-[(Z)-2-thiophen-2-ylethenyl]pyrazine;2-(4-methylsulfonylphenyl)-6-[(1S)-1-thiophen-2-ylethoxy]pyrazine;6-(6-methylsulfonyl-3-pyridinyl)-N-(thiophen-2-ylmethyl)pyridin-2-amine has a molecular weight of 2487.10 g/mol, XLogP of 23.01, 36 rotatable bonds, 3 hydrogen bond donors, and 43 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(furan-3-ylmethoxy)-6-(4-methylsulfonylphenyl)pyrazine;N-(furan-3-ylmethyl)-N-methyl-6-(4-methylsulfonylphenyl)pyridin-2-amine;5-methoxy-6-(4-methylsulfonylphenyl)-N-[(3-methylthiophen-2-yl)methyl]pyrazin-2-amine;5-methoxy-6-(6-methylsulfonyl-3-pyridinyl)-N-(thiophen-2-ylmethyl)pyrazin-2-amine;2-(4-methylsulfonylphenyl)-6-[(Z)-2-thiophen-2-ylethenyl]pyrazine;2-(4-methylsulfonylphenyl)-6-[(1S)-1-thiophen-2-ylethoxy]pyrazine;6-(6-methylsulfonyl-3-pyridinyl)-N-(thiophen-2-ylmethyl)pyridin-2-amine is sourced from PubChem (CID 167564561), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).