6-(4-methylsulfonylphenoxy)-N-(thiophen-2-ylmethyl)pyridin-2-amine;bis(2-[6-(4-methylsulfonylphenyl)pyrazin-2-yl]-1,3-dihydroisoindole);2-(4-methylsulfonylphenyl)-6-(2-thiophen-2-ylethoxy)pyrazine;2-(4-methylsulfonylphenyl)-4-(thiophen-2-ylmethoxy)pyridine;6-(4-methylsulfonylphenyl)-2-(thiophen-2-ylmethyl)pyrazolo[4,3-b]pyridine

C107H96N14O15S10 — CID 167550764

IUPAC6-(4-methylsulfonylphenoxy)-N-(thiophen-2-ylmethyl)pyridin-2-amine;bis(2-[6-(4-methylsulfonylphenyl)pyrazin-2-yl]-1,3-dihydroisoindole);2-(4-methylsulfonylphenyl)-6-(2-thiophen-2-ylethoxy)pyrazine;2-(4-methylsulfonylphenyl)-4-(thiophen-2-ylmethoxy)pyridine;6-(4-methylsulfonylphenyl)-2-(thiophen-2-ylmethyl)pyrazolo[4,3-b]pyridine
SMILESCS(=O)(=O)c1ccc(-c2cc(OCc3cccs3)ccn2)cc1.CS(=O)(=O)c1ccc(-c2cnc3cn(Cc4cccs4)nc3c2)cc1.CS(=O)(=O)c1ccc(-c2cncc(N3Cc4ccccc4C3)n2)cc1.CS(=O)(=O)c1ccc(-c2cncc(N3Cc4ccccc4C3)n2)cc1.CS(=O)(=O)c1ccc(-c2cncc(OCCc3cccs3)n2)cc1.CS(=O)(=O)c1ccc(Oc2cccc(NCc3cccs3)n2)cc1
InChIInChI=1S/2C19H17N3O2S.C18H15N3O2S2.2C17H16N2O3S2.C17H15NO3S2/c2*1-25(23,24)17-8-6-14(7-9-17)18-10-20-11-19(21-18)22-12-15-4-2-3-5-16(15)13-22;1-25(22,23)16-6-4-13(5-7-16)14-9-17-18(19-10-14)12-21(20-17)11-15-3-2-8-24-15;1-24(20,21)15-9-7-13(8-10-15)22-17-6-2-5-16(19-17)18-12-14-4-3-11-23-14;1-24(20,21)15-6-4-13(5-7-15)16-11-18-12-17(19-16)22-9-8-14-3-2-10-23-14;1-23(19,20)16-6-4-13(5-7-16)17-11-14(8-9-18-17)21-12-15-3-2-10-22-15/h2*2-11H,12-13H2,1H3;2-10,12H,11H2,1H3;2-11H,12H2,1H3,(H,18,19);2-7,10-12H,8-9H2,1H3;2-11H,12H2,1H3
InChIKeyCJHMMBSKHLYKOS-UHFFFAOYSA-N
MW2138.70 g/mol
LogP20.72
Rot. Bonds27

About 6-(4-methylsulfonylphenoxy)-N-(thiophen-2-ylmethyl)pyridin-2-amine;bis(2-[6-(4-methylsulfonylphenyl)pyrazin-2-yl]-1,3-dihydroisoindole);2-(4-methylsulfonylphenyl)-6-(2-thiophen-2-ylethoxy)pyrazine;2-(4-methylsulfonylphenyl)-4-(thiophen-2-ylmethoxy)pyridine;6-(4-methylsulfonylphenyl)-2-(thiophen-2-ylmethyl)pyrazolo[4,3-b]pyridine

6-(4-methylsulfonylphenoxy)-N-(thiophen-2-ylmethyl)pyridin-2-amine;bis(2-[6-(4-methylsulfonylphenyl)pyrazin-2-yl]-1,3-dihydroisoindole);2-(4-methylsulfonylphenyl)-6-(2-thiophen-2-ylethoxy)pyrazine;2-(4-methylsulfonylphenyl)-4-(thiophen-2-ylmethoxy)pyridine;6-(4-methylsulfonylphenyl)-2-(thiophen-2-ylmethyl)pyrazolo[4,3-b]pyridine (PubChem CID 167550764) has the molecular formula C107H96N14O15S10 and a molecular weight of 2138.70 g/mol. Its IUPAC name is 6-(4-methylsulfonylphenoxy)-N-(thiophen-2-ylmethyl)pyridin-2-amine;bis(2-[6-(4-methylsulfonylphenyl)pyrazin-2-yl]-1,3-dihydroisoindole);2-(4-methylsulfonylphenyl)-6-(2-thiophen-2-ylethoxy)pyrazine;2-(4-methylsulfonylphenyl)-4-(thiophen-2-ylmethoxy)pyridine;6-(4-methylsulfonylphenyl)-2-(thiophen-2-ylmethyl)pyrazolo[4,3-b]pyridine.

Molecular Properties

Compound Name6-(4-methylsulfonylphenoxy)-N-(thiophen-2-ylmethyl)pyridin-2-amine;bis(2-[6-(4-methylsulfonylphenyl)pyrazin-2-yl]-1,3-dihydroisoindole);2-(4-methylsulfonylphenyl)-6-(2-thiophen-2-ylethoxy)pyrazine;2-(4-methylsulfonylphenyl)-4-(thiophen-2-ylmethoxy)pyridine;6-(4-methylsulfonylphenyl)-2-(thiophen-2-ylmethyl)pyrazolo[4,3-b]pyridine
PubChem CID167550764
Molecular FormulaC107H96N14O15S10
Molecular Weight2138.70 g/mol
Exact Mass2136.44
IUPAC Name6-(4-methylsulfonylphenoxy)-N-(thiophen-2-ylmethyl)pyridin-2-amine;bis(2-[6-(4-methylsulfonylphenyl)pyrazin-2-yl]-1,3-dihydroisoindole);2-(4-methylsulfonylphenyl)-6-(2-thiophen-2-ylethoxy)pyrazine;2-(4-methylsulfonylphenyl)-4-(thiophen-2-ylmethoxy)pyridine;6-(4-methylsulfonylphenyl)-2-(thiophen-2-ylmethyl)pyrazolo[4,3-b]pyridine
SMILESCS(=O)(=O)c1ccc(-c2cc(OCc3cccs3)ccn2)cc1.CS(=O)(=O)c1ccc(-c2cnc3cn(Cc4cccs4)nc3c2)cc1.CS(=O)(=O)c1ccc(-c2cncc(N3Cc4ccccc4C3)n2)cc1.CS(=O)(=O)c1ccc(-c2cncc(N3Cc4ccccc4C3)n2)cc1.CS(=O)(=O)c1ccc(-c2cncc(OCCc3cccs3)n2)cc1.CS(=O)(=O)c1ccc(Oc2cccc(NCc3cccs3)n2)cc1
InChIInChI=1S/2C19H17N3O2S.C18H15N3O2S2.2C17H16N2O3S2.C17H15NO3S2/c2*1-25(23,24)17-8-6-14(7-9-17)18-10-20-11-19(21-18)22-12-15-4-2-3-5-16(15)13-22;1-25(22,23)16-6-4-13(5-7-16)14-9-17-18(19-10-14)12-21(20-17)11-15-3-2-8-24-15;1-24(20,21)15-9-7-13(8-10-15)22-17-6-2-5-16(19-17)18-12-14-4-3-11-23-14;1-24(20,21)15-6-4-13(5-7-15)16-11-18-12-17(19-16)22-9-8-14-3-2-10-23-14;1-23(19,20)16-6-4-13(5-7-16)17-11-14(8-9-18-17)21-12-15-3-2-10-22-15/h2*2-11H,12-13H2,1H3;2-10,12H,11H2,1H3;2-11H,12H2,1H3,(H,18,19);2-7,10-12H,8-9H2,1H3;2-11H,12H2,1H3
InChIKeyCJHMMBSKHLYKOS-UHFFFAOYSA-N
XLogP20.72
TPSA384.87 Ų
H-Bond Donors1
H-Bond Acceptors33
Rotatable Bonds27
Heavy Atoms146
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002138.70
LogP ≤ 520.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1033

Analyze 6-(4-methylsulfonylphenoxy)-N-(thiophen-2-ylmethyl)pyridin-2-amine;bis(2-[6-(4-methylsulfonylphenyl)pyrazin-2-yl]-1,3-dihydroisoindole);2-(4-methylsulfonylphenyl)-6-(2-thiophen-2-ylethoxy)pyrazine;2-(4-methylsulfonylphenyl)-4-(thiophen-2-ylmethoxy)pyridine;6-(4-methylsulfonylphenyl)-2-(thiophen-2-ylmethyl)pyrazolo[4,3-b]pyridine with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 6-(4-methylsulfonylphenoxy)-N-(thiophen-2-ylmethyl)pyridin-2-amine;bis(2-[6-(4-methylsulfonylphenyl)pyrazin-2-yl]-1,3-dihydroisoindole);2-(4-methylsulfonylphenyl)-6-(2-thiophen-2-ylethoxy)pyrazine;2-(4-methylsulfonylphenyl)-4-(thiophen-2-ylmethoxy)pyridine;6-(4-methylsulfonylphenyl)-2-(thiophen-2-ylmethyl)pyrazolo[4,3-b]pyridine?
The IUPAC name of 6-(4-methylsulfonylphenoxy)-N-(thiophen-2-ylmethyl)pyridin-2-amine;bis(2-[6-(4-methylsulfonylphenyl)pyrazin-2-yl]-1,3-dihydroisoindole);2-(4-methylsulfonylphenyl)-6-(2-thiophen-2-ylethoxy)pyrazine;2-(4-methylsulfonylphenyl)-4-(thiophen-2-ylmethoxy)pyridine;6-(4-methylsulfonylphenyl)-2-(thiophen-2-ylmethyl)pyrazolo[4,3-b]pyridine (CID 167550764) is 6-(4-methylsulfonylphenoxy)-N-(thiophen-2-ylmethyl)pyridin-2-amine;bis(2-[6-(4-methylsulfonylphenyl)pyrazin-2-yl]-1,3-dihydroisoindole);2-(4-methylsulfonylphenyl)-6-(2-thiophen-2-ylethoxy)pyrazine;2-(4-methylsulfonylphenyl)-4-(thiophen-2-ylmethoxy)pyridine;6-(4-methylsulfonylphenyl)-2-(thiophen-2-ylmethyl)pyrazolo[4,3-b]pyridine.
What is the SMILES notation for 6-(4-methylsulfonylphenoxy)-N-(thiophen-2-ylmethyl)pyridin-2-amine;bis(2-[6-(4-methylsulfonylphenyl)pyrazin-2-yl]-1,3-dihydroisoindole);2-(4-methylsulfonylphenyl)-6-(2-thiophen-2-ylethoxy)pyrazine;2-(4-methylsulfonylphenyl)-4-(thiophen-2-ylmethoxy)pyridine;6-(4-methylsulfonylphenyl)-2-(thiophen-2-ylmethyl)pyrazolo[4,3-b]pyridine?
The canonical SMILES for 6-(4-methylsulfonylphenoxy)-N-(thiophen-2-ylmethyl)pyridin-2-amine;bis(2-[6-(4-methylsulfonylphenyl)pyrazin-2-yl]-1,3-dihydroisoindole);2-(4-methylsulfonylphenyl)-6-(2-thiophen-2-ylethoxy)pyrazine;2-(4-methylsulfonylphenyl)-4-(thiophen-2-ylmethoxy)pyridine;6-(4-methylsulfonylphenyl)-2-(thiophen-2-ylmethyl)pyrazolo[4,3-b]pyridine is CS(=O)(=O)c1ccc(-c2cc(OCc3cccs3)ccn2)cc1.CS(=O)(=O)c1ccc(-c2cnc3cn(Cc4cccs4)nc3c2)cc1.CS(=O)(=O)c1ccc(-c2cncc(N3Cc4ccccc4C3)n2)cc1.CS(=O)(=O)c1ccc(-c2cncc(N3Cc4ccccc4C3)n2)cc1.CS(=O)(=O)c1ccc(-c2cncc(OCCc3cccs3)n2)cc1.CS(=O)(=O)c1ccc(Oc2cccc(NCc3cccs3)n2)cc1.
What is the InChIKey of 6-(4-methylsulfonylphenoxy)-N-(thiophen-2-ylmethyl)pyridin-2-amine;bis(2-[6-(4-methylsulfonylphenyl)pyrazin-2-yl]-1,3-dihydroisoindole);2-(4-methylsulfonylphenyl)-6-(2-thiophen-2-ylethoxy)pyrazine;2-(4-methylsulfonylphenyl)-4-(thiophen-2-ylmethoxy)pyridine;6-(4-methylsulfonylphenyl)-2-(thiophen-2-ylmethyl)pyrazolo[4,3-b]pyridine?
The InChIKey is CJHMMBSKHLYKOS-UHFFFAOYSA-N. The full InChI is InChI=1S/2C19H17N3O2S.C18H15N3O2S2.2C17H16N2O3S2.C17H15NO3S2/c2*1-25(23,24)17-8-6-14(7-9-17)18-10-20-11-19(21-18)22-12-15-4-2-3-5-16(15)13-22;1-25(22,23)16-6-4-13(5-7-16)14-9-17-18(19-10-14)12-21(20-17)11-15-3-2-8-24-15;1-24(20,21)15-9-7-13(8-10-15)22-17-6-2-5-16(19-17)18-12-14-4-3-11-23-14;1-24(20,21)15-6-4-13(5-7-15)16-11-18-12-17(19-16)22-9-8-14-3-2-10-23-14;1-23(19,20)16-6-4-13(5-7-16)17-11-14(8-9-18-17)21-12-15-3-2-10-22-15/h2*2-11H,12-13H2,1H3;2-10,12H,11H2,1H3;2-11H,12H2,1H3,(H,18,19);2-7,10-12H,8-9H2,1H3;2-11H,12H2,1H3.
What are the key properties of 6-(4-methylsulfonylphenoxy)-N-(thiophen-2-ylmethyl)pyridin-2-amine;bis(2-[6-(4-methylsulfonylphenyl)pyrazin-2-yl]-1,3-dihydroisoindole);2-(4-methylsulfonylphenyl)-6-(2-thiophen-2-ylethoxy)pyrazine;2-(4-methylsulfonylphenyl)-4-(thiophen-2-ylmethoxy)pyridine;6-(4-methylsulfonylphenyl)-2-(thiophen-2-ylmethyl)pyrazolo[4,3-b]pyridine?
6-(4-methylsulfonylphenoxy)-N-(thiophen-2-ylmethyl)pyridin-2-amine;bis(2-[6-(4-methylsulfonylphenyl)pyrazin-2-yl]-1,3-dihydroisoindole);2-(4-methylsulfonylphenyl)-6-(2-thiophen-2-ylethoxy)pyrazine;2-(4-methylsulfonylphenyl)-4-(thiophen-2-ylmethoxy)pyridine;6-(4-methylsulfonylphenyl)-2-(thiophen-2-ylmethyl)pyrazolo[4,3-b]pyridine has a molecular weight of 2138.70 g/mol, XLogP of 20.72, 27 rotatable bonds, 1 hydrogen bond donors, and 33 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-methylsulfonylphenoxy)-N-(thiophen-2-ylmethyl)pyridin-2-amine;bis(2-[6-(4-methylsulfonylphenyl)pyrazin-2-yl]-1,3-dihydroisoindole);2-(4-methylsulfonylphenyl)-6-(2-thiophen-2-ylethoxy)pyrazine;2-(4-methylsulfonylphenyl)-4-(thiophen-2-ylmethoxy)pyridine;6-(4-methylsulfonylphenyl)-2-(thiophen-2-ylmethyl)pyrazolo[4,3-b]pyridine is sourced from PubChem (CID 167550764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).