N-(furan-3-ylmethyl)-1-(4-methylsulfonylphenyl)pyrrolo[2,3-b]pyridin-6-amine;methane;3-(4-methylsulfonylphenyl)-N-phenylfuro[3,2-b]pyridin-5-amine;1-(4-methylsulfonylphenyl)-N-(thiophen-2-ylmethyl)pyrazolo[5,4-b]pyridin-6-amine;1-(4-methylsulfonylphenyl)-N-(thiophen-2-ylmethyl)pyrrolo[2,3-b]pyridin-6-amine;7-(4-methylsulfonylphenyl)-N-(thiophen-2-ylmethyl)pyrrolo[2,3-d]pyrimidin-2-amine

C99H102N16O12S8 — CID 167705898

IUPACN-(furan-3-ylmethyl)-1-(4-methylsulfonylphenyl)pyrrolo[2,3-b]pyridin-6-amine;methane;3-(4-methylsulfonylphenyl)-N-phenylfuro[3,2-b]pyridin-5-amine;1-(4-methylsulfonylphenyl)-N-(thiophen-2-ylmethyl)pyrazolo[5,4-b]pyridin-6-amine;1-(4-methylsulfonylphenyl)-N-(thiophen-2-ylmethyl)pyrrolo[2,3-b]pyridin-6-amine;7-(4-methylsulfonylphenyl)-N-(thiophen-2-ylmethyl)pyrrolo[2,3-d]pyrimidin-2-amine
SMILESC.C.C.C.C.CS(=O)(=O)c1ccc(-c2coc3ccc(Nc4ccccc4)nc23)cc1.CS(=O)(=O)c1ccc(-n2ccc3ccc(NCc4cccs4)nc32)cc1.CS(=O)(=O)c1ccc(-n2ccc3ccc(NCc4ccoc4)nc32)cc1.CS(=O)(=O)c1ccc(-n2ccc3cnc(NCc4cccs4)nc32)cc1.CS(=O)(=O)c1ccc(-n2ncc3ccc(NCc4cccs4)nc32)cc1
InChIInChI=1S/C20H16N2O3S.C19H17N3O3S.C19H17N3O2S2.2C18H16N4O2S2.5CH4/c1-26(23,24)16-9-7-14(8-10-16)17-13-25-18-11-12-19(22-20(17)18)21-15-5-3-2-4-6-15;1-26(23,24)17-5-3-16(4-6-17)22-10-8-15-2-7-18(21-19(15)22)20-12-14-9-11-25-13-14;1-26(23,24)17-7-5-15(6-8-17)22-11-10-14-4-9-18(21-19(14)22)20-13-16-3-2-12-25-16;1-26(23,24)16-7-5-14(6-8-16)22-18-13(11-20-22)4-9-17(21-18)19-12-15-3-2-10-25-15;1-26(23,24)16-6-4-14(5-7-16)22-9-8-13-11-19-18(21-17(13)22)20-12-15-3-2-10-25-15;;;;;/h2-13H,1H3,(H,21,22);2-11,13H,12H2,1H3,(H,20,21);2-12H,13H2,1H3,(H,20,21);2-11H,12H2,1H3,(H,19,21);2-11H,12H2,1H3,(H,19,20,21);5*1H4
InChIKeyZCGXHBATYQAPTN-UHFFFAOYSA-N
MW1964.54 g/mol
LogP22.55
Rot. Bonds24

About N-(furan-3-ylmethyl)-1-(4-methylsulfonylphenyl)pyrrolo[2,3-b]pyridin-6-amine;methane;3-(4-methylsulfonylphenyl)-N-phenylfuro[3,2-b]pyridin-5-amine;1-(4-methylsulfonylphenyl)-N-(thiophen-2-ylmethyl)pyrazolo[5,4-b]pyridin-6-amine;1-(4-methylsulfonylphenyl)-N-(thiophen-2-ylmethyl)pyrrolo[2,3-b]pyridin-6-amine;7-(4-methylsulfonylphenyl)-N-(thiophen-2-ylmethyl)pyrrolo[2,3-d]pyrimidin-2-amine

N-(furan-3-ylmethyl)-1-(4-methylsulfonylphenyl)pyrrolo[2,3-b]pyridin-6-amine;methane;3-(4-methylsulfonylphenyl)-N-phenylfuro[3,2-b]pyridin-5-amine;1-(4-methylsulfonylphenyl)-N-(thiophen-2-ylmethyl)pyrazolo[5,4-b]pyridin-6-amine;1-(4-methylsulfonylphenyl)-N-(thiophen-2-ylmethyl)pyrrolo[2,3-b]pyridin-6-amine;7-(4-methylsulfonylphenyl)-N-(thiophen-2-ylmethyl)pyrrolo[2,3-d]pyrimidin-2-amine (PubChem CID 167705898) has the molecular formula C99H102N16O12S8 and a molecular weight of 1964.54 g/mol. Its IUPAC name is N-(furan-3-ylmethyl)-1-(4-methylsulfonylphenyl)pyrrolo[2,3-b]pyridin-6-amine;methane;3-(4-methylsulfonylphenyl)-N-phenylfuro[3,2-b]pyridin-5-amine;1-(4-methylsulfonylphenyl)-N-(thiophen-2-ylmethyl)pyrazolo[5,4-b]pyridin-6-amine;1-(4-methylsulfonylphenyl)-N-(thiophen-2-ylmethyl)pyrrolo[2,3-b]pyridin-6-amine;7-(4-methylsulfonylphenyl)-N-(thiophen-2-ylmethyl)pyrrolo[2,3-d]pyrimidin-2-amine.

Molecular Properties

Compound NameN-(furan-3-ylmethyl)-1-(4-methylsulfonylphenyl)pyrrolo[2,3-b]pyridin-6-amine;methane;3-(4-methylsulfonylphenyl)-N-phenylfuro[3,2-b]pyridin-5-amine;1-(4-methylsulfonylphenyl)-N-(thiophen-2-ylmethyl)pyrazolo[5,4-b]pyridin-6-amine;1-(4-methylsulfonylphenyl)-N-(thiophen-2-ylmethyl)pyrrolo[2,3-b]pyridin-6-amine;7-(4-methylsulfonylphenyl)-N-(thiophen-2-ylmethyl)pyrrolo[2,3-d]pyrimidin-2-amine
PubChem CID167705898
Molecular FormulaC99H102N16O12S8
Molecular Weight1964.54 g/mol
Exact Mass1962.56
IUPAC NameN-(furan-3-ylmethyl)-1-(4-methylsulfonylphenyl)pyrrolo[2,3-b]pyridin-6-amine;methane;3-(4-methylsulfonylphenyl)-N-phenylfuro[3,2-b]pyridin-5-amine;1-(4-methylsulfonylphenyl)-N-(thiophen-2-ylmethyl)pyrazolo[5,4-b]pyridin-6-amine;1-(4-methylsulfonylphenyl)-N-(thiophen-2-ylmethyl)pyrrolo[2,3-b]pyridin-6-amine;7-(4-methylsulfonylphenyl)-N-(thiophen-2-ylmethyl)pyrrolo[2,3-d]pyrimidin-2-amine
SMILESC.C.C.C.C.CS(=O)(=O)c1ccc(-c2coc3ccc(Nc4ccccc4)nc23)cc1.CS(=O)(=O)c1ccc(-n2ccc3ccc(NCc4cccs4)nc32)cc1.CS(=O)(=O)c1ccc(-n2ccc3ccc(NCc4ccoc4)nc32)cc1.CS(=O)(=O)c1ccc(-n2ccc3cnc(NCc4cccs4)nc32)cc1.CS(=O)(=O)c1ccc(-n2ncc3ccc(NCc4cccs4)nc32)cc1
InChIInChI=1S/C20H16N2O3S.C19H17N3O3S.C19H17N3O2S2.2C18H16N4O2S2.5CH4/c1-26(23,24)16-9-7-14(8-10-16)17-13-25-18-11-12-19(22-20(17)18)21-15-5-3-2-4-6-15;1-26(23,24)17-5-3-16(4-6-17)22-10-8-15-2-7-18(21-19(15)22)20-12-14-9-11-25-13-14;1-26(23,24)17-7-5-15(6-8-17)22-11-10-14-4-9-18(21-19(14)22)20-13-16-3-2-12-25-16;1-26(23,24)16-7-5-14(6-8-16)22-18-13(11-20-22)4-9-17(21-18)19-12-15-3-2-10-25-15;1-26(23,24)16-6-4-14(5-7-16)22-9-8-13-11-19-18(21-17(13)22)20-12-15-3-2-10-25-15;;;;;/h2-13H,1H3,(H,21,22);2-11,13H,12H2,1H3,(H,20,21);2-12H,13H2,1H3,(H,20,21);2-11H,12H2,1H3,(H,19,21);2-11H,12H2,1H3,(H,19,20,21);5*1H4
InChIKeyZCGXHBATYQAPTN-UHFFFAOYSA-N
XLogP22.55
TPSA367.08 Ų
H-Bond Donors5
H-Bond Acceptors31
Rotatable Bonds24
Heavy Atoms135
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001964.54
LogP ≤ 522.55
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1031

Analyze N-(furan-3-ylmethyl)-1-(4-methylsulfonylphenyl)pyrrolo[2,3-b]pyridin-6-amine;methane;3-(4-methylsulfonylphenyl)-N-phenylfuro[3,2-b]pyridin-5-amine;1-(4-methylsulfonylphenyl)-N-(thiophen-2-ylmethyl)pyrazolo[5,4-b]pyridin-6-amine;1-(4-methylsulfonylphenyl)-N-(thiophen-2-ylmethyl)pyrrolo[2,3-b]pyridin-6-amine;7-(4-methylsulfonylphenyl)-N-(thiophen-2-ylmethyl)pyrrolo[2,3-d]pyrimidin-2-amine with MolForge

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Related Compounds

5-[2-methylsulfonyl-6-[4-(oxan-2-yl)phenyl]-3-(trifluoromethyl)phenyl]-2H-tetrazole;6-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)-4-(trifluoromethyl)phenyl]furo[3,2-b]pyridine;3-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)-4-(trifluoromethyl)phenyl]imidazo[1,2-a]pyrimidine;3-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)-4-(trifluoromethyl)phenyl]pyrazolo[1,5-a]pyridine;4-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)-4-(trifluoromethyl)phenyl]pyridine-2,6-diamine;5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)-4-(trifluoromethyl)phenyl]-1H-pyrrolo[2,3-b]pyridine;3-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)-4-(trifluoromethyl)phenyl]-[1,2]thiazolo[3,4-b]pyridine
CID 160957899
1-[7-Amino-5-(1,1-dioxothian-4-yl)-3-(6-phenyl-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-6-yl]ethanone;6-bromo-5-(1,1-dioxothian-4-yl)-3-(6-phenoxy-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-7-amine;5-(1,1-dioxothian-4-yl)-6-(furan-2-yl)-3-quinolin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine;5-(1,1-dioxothian-4-yl)-3-(6-phenyl-3-pyridinyl)-6-thiophen-2-ylpyrazolo[1,5-a]pyrimidin-7-amine;5-(1,1-dioxothian-4-yl)-3-quinolin-3-yl-6-thiophen-2-ylpyrazolo[1,5-a]pyrimidin-7-amine
CID 157057792
8-amino-N-ethyl-N-(2-methoxyethyl)-2-(5-methylfuran-2-yl)-[1,2,4]triazolo[1,5-a]pyridine-6-carboxamide;[8-amino-2-(5-methylfuran-2-yl)-[1,2,4]triazolo[1,5-a]pyridin-6-yl]-(3-methylpiperidin-1-yl)methanone;[8-amino-2-(5-methylfuran-2-yl)-[1,2,4]triazolo[1,5-a]pyridin-6-yl]-thiomorpholin-4-ylmethanone;8-amino-N-methyl-2-(5-methylfuran-2-yl)-N-propyl-[1,2,4]triazolo[1,5-a]pyridine-6-carboxamide;[4-amino-2-(5-methylthiophen-2-yl)pyrazolo[1,5-a]pyridin-6-yl]-pyrrolidin-1-ylmethanone;[8-amino-2-(5-methylthiophen-2-yl)-[1,2,4]triazolo[1,5-a]pyridin-6-yl]-[(2R)-2-(methoxymethyl)pyrrolidin-1-yl]methanone;[8-amino-2-(5-methylthiophen-2-yl)-[1,2,4]triazolo[1,5-a]pyridin-6-yl]-(2-methylpyrrolidin-1-yl)methanone;[8-amino-2-(5-methylthiophen-2-yl)-[1,2,4]triazolo[1,5-a]pyridin-6-yl]-piperidin-1-ylmethanone
CID 157068617
CID 157179881
CID 157179881
methane;2-methyl-9-propan-2-ylpurin-6-amine;2-methyl-9-propan-2-yl-1H-purin-6-one;7-propan-2-yl-5H-cyclopenta[b]pyridin-4-amine;3-propan-2-ylfuro[3,2-b]pyridin-7-amine;3-propan-2-ylimidazo[1,2-b]pyridazin-8-amine;9-propan-2-ylpurin-6-amine;7-propan-2-ylpyrrolo[1,2-b]pyridazin-4-amine;7-propan-2-yl-5H-pyrrolo[3,4-b]pyridin-4-amine;7-propan-2-ylpyrrolo[2,3-d]pyrimidin-4-amine;7-propan-2-yl-6H-pyrrolo[3,4-d]pyrimidin-4-amine;3-propan-2-ylthieno[3,2-b]pyridin-7-amine;7-propan-2-ylthieno[3,4-b]pyridin-4-amine
CID 157201546
1,3-benzothiazole;1,3-benzoxazole;5H-cyclopenta[b]pyridine;5H-cyclopenta[d]pyrimidine;furo[3,2-b]pyridine;furo[3,2-d]pyrimidine;imidazo[1,2-a]pyridine;imidazo[1,2-a]pyrimidine;imidazo[1,2-b]pyridazine;imidazo[1,2-c]pyrimidine;3H-indole;1H-pyrrolo[2,3-b]pyridine;1H-pyrrolo[2,3-c]pyridine;thieno[3,2-b]pyridine;thieno[3,2-d]pyrimidine;[1,2,4]triazolo[1,5-a]pyridine;[1,2,4]triazolo[4,3-a]pyridine
CID 157301762
CID 157369084
CID 157369084
2-methylfuro[2,3-c]pyridin-7-amine;2-methylfuro[3,2-c]pyridin-4-amine;3-methylfuro[2,3-c]pyridin-7-amine;3-methylfuro[3,2-c]pyridin-4-amine;bis(2-methyl-1H-imidazo[4,5-c]pyridin-4-amine);3-methylimidazo[4,5-c]pyridin-4-amine;5-methyl-1H-pyrazolo[4,5-b]pyridine;5-methyl-1H-pyrrolo[3,2-b]pyridine;2-methyl-1H-pyrrolo[2,3-c]pyridin-7-amine;2-methyl-1H-pyrrolo[3,2-c]pyridin-4-amine;3-methyl-1H-pyrrolo[3,2-c]pyridin-4-amine;2-methyl-1H-pyrrolo[2,3-c]pyridine;2-methyl-1H-pyrrolo[3,2-c]pyridine;3-methyl-1H-pyrrolo[2,3-c]pyridine;3-methyl-1H-pyrrolo[3,2-c]pyridine;2-methylthieno[2,3-c]pyridin-7-amine;2-methylthieno[3,2-c]pyridin-4-amine;3-methylthieno[2,3-c]pyridin-7-amine;3-methylthieno[3,2-c]pyridin-4-amine
CID 157486329
N-[4-[[3-(1-benzofuran-2-yl)pyrazolo[1,5-a]pyrimidin-5-yl]amino]phenyl]-4-methylbenzenesulfonamide;4-methyl-N-[4-[(3-thiophen-3-ylpyrazolo[1,5-a]pyrimidin-5-yl)amino]phenyl]benzenesulfonamide
CID 157509716
1,2-Dimethyl-3,6-di(propan-2-yl)pyrrolo[2,3-b]pyridine;1,3-dimethyl-2,5-di(propan-2-yl)pyrrolo[2,3-c]pyridine;2,5-di(propan-2-yl)-2,3-dihydrofuro[2,3-c]pyridine;2,6-di(propan-2-yl)-6,7-dihydrofuro[3,2-d]pyrimidine;1,5-di(propan-2-yl)pyrrolo[3,2-b]pyridine;ethane;3-methyl-2,5-di(propan-2-yl)furo[3,2-b]pyridine;3-methyl-2,5-di(propan-2-yl)furo[2,3-c]pyridine;3-methyl-1,5-di(propan-2-yl)pyrazolo[4,5-b]pyridine;3-methyl-1,5-di(propan-2-yl)pyrazolo[4,3-d]pyrimidine;7-methyl-2,5-di(propan-2-yl)pyrrolo[2,3-d]pyrimidine;7-methyl-2,5-di(propan-2-yl)pyrrolo[3,2-d]pyrimidine;3-methyl-2,5-di(propan-2-yl)thieno[3,2-b]pyridine;3-methyl-2,5-di(propan-2-yl)thieno[2,3-c]pyridine
CID 157520083
4,6a-dihydro-3aH-thieno[2,3-c]pyrrole;1-benzofuran;1-benzothiophene;1,3-benzoxazole;imidazo[1,2-a]pyrazine;imidazo[1,2-a]pyridine;imidazo[1,2-a]pyrimidine;imidazo[1,2-b]pyridazine;imidazo[1,2-c]pyrimidine;bis(1H-indole);3H-indole;[1,3]oxazolo[4,5-b]pyridine;[1,3]oxazolo[5,4-b]pyridine;[1,3]oxazolo[4,5-c]pyridine;[1,3]oxazolo[5,4-c]pyridine;bis(1H-pyrrolo[2,3-b]pyridine);bis(1H-pyrrolo[3,2-b]pyridine);3H-pyrrolo[2,3-b]pyridine;bis(3H-pyrrolo[3,2-b]pyridine);bis(1H-pyrrolo[2,3-c]pyridine);bis(1H-pyrrolo[3,2-c]pyridine);3H-pyrrolo[2,3-c]pyridine;3H-pyrrolo[3,2-c]pyridine;thieno[2,3-b]pyridine
CID 157542826
5H-cyclopenta[b]pyridine;tris(6H-cyclopenta[d]pyrimidine);furo[2,3-b]pyridine;furo[3,2-b]pyridine;imidazo[1,2-a]pyridine;tris(2H-indole);indolizine;pyrazolo[1,5-a]pyridine;pyrrolo[1,2-a]pyrazine;pyrrolo[1,2-a]pyrimidine;pyrrolo[1,2-b]pyridazine;1H-pyrrolo[2,3-b]pyridine;tris(2H-pyrrolo[2,3-b]pyridine);pyrrolo[1,2-c]pyrimidine;thieno[2,3-b]pyridine
CID 157551389

Frequently Asked Questions

What is the IUPAC name of N-(furan-3-ylmethyl)-1-(4-methylsulfonylphenyl)pyrrolo[2,3-b]pyridin-6-amine;methane;3-(4-methylsulfonylphenyl)-N-phenylfuro[3,2-b]pyridin-5-amine;1-(4-methylsulfonylphenyl)-N-(thiophen-2-ylmethyl)pyrazolo[5,4-b]pyridin-6-amine;1-(4-methylsulfonylphenyl)-N-(thiophen-2-ylmethyl)pyrrolo[2,3-b]pyridin-6-amine;7-(4-methylsulfonylphenyl)-N-(thiophen-2-ylmethyl)pyrrolo[2,3-d]pyrimidin-2-amine?
The IUPAC name of N-(furan-3-ylmethyl)-1-(4-methylsulfonylphenyl)pyrrolo[2,3-b]pyridin-6-amine;methane;3-(4-methylsulfonylphenyl)-N-phenylfuro[3,2-b]pyridin-5-amine;1-(4-methylsulfonylphenyl)-N-(thiophen-2-ylmethyl)pyrazolo[5,4-b]pyridin-6-amine;1-(4-methylsulfonylphenyl)-N-(thiophen-2-ylmethyl)pyrrolo[2,3-b]pyridin-6-amine;7-(4-methylsulfonylphenyl)-N-(thiophen-2-ylmethyl)pyrrolo[2,3-d]pyrimidin-2-amine (CID 167705898) is N-(furan-3-ylmethyl)-1-(4-methylsulfonylphenyl)pyrrolo[2,3-b]pyridin-6-amine;methane;3-(4-methylsulfonylphenyl)-N-phenylfuro[3,2-b]pyridin-5-amine;1-(4-methylsulfonylphenyl)-N-(thiophen-2-ylmethyl)pyrazolo[5,4-b]pyridin-6-amine;1-(4-methylsulfonylphenyl)-N-(thiophen-2-ylmethyl)pyrrolo[2,3-b]pyridin-6-amine;7-(4-methylsulfonylphenyl)-N-(thiophen-2-ylmethyl)pyrrolo[2,3-d]pyrimidin-2-amine.
What is the SMILES notation for N-(furan-3-ylmethyl)-1-(4-methylsulfonylphenyl)pyrrolo[2,3-b]pyridin-6-amine;methane;3-(4-methylsulfonylphenyl)-N-phenylfuro[3,2-b]pyridin-5-amine;1-(4-methylsulfonylphenyl)-N-(thiophen-2-ylmethyl)pyrazolo[5,4-b]pyridin-6-amine;1-(4-methylsulfonylphenyl)-N-(thiophen-2-ylmethyl)pyrrolo[2,3-b]pyridin-6-amine;7-(4-methylsulfonylphenyl)-N-(thiophen-2-ylmethyl)pyrrolo[2,3-d]pyrimidin-2-amine?
The canonical SMILES for N-(furan-3-ylmethyl)-1-(4-methylsulfonylphenyl)pyrrolo[2,3-b]pyridin-6-amine;methane;3-(4-methylsulfonylphenyl)-N-phenylfuro[3,2-b]pyridin-5-amine;1-(4-methylsulfonylphenyl)-N-(thiophen-2-ylmethyl)pyrazolo[5,4-b]pyridin-6-amine;1-(4-methylsulfonylphenyl)-N-(thiophen-2-ylmethyl)pyrrolo[2,3-b]pyridin-6-amine;7-(4-methylsulfonylphenyl)-N-(thiophen-2-ylmethyl)pyrrolo[2,3-d]pyrimidin-2-amine is C.C.C.C.C.CS(=O)(=O)c1ccc(-c2coc3ccc(Nc4ccccc4)nc23)cc1.CS(=O)(=O)c1ccc(-n2ccc3ccc(NCc4cccs4)nc32)cc1.CS(=O)(=O)c1ccc(-n2ccc3ccc(NCc4ccoc4)nc32)cc1.CS(=O)(=O)c1ccc(-n2ccc3cnc(NCc4cccs4)nc32)cc1.CS(=O)(=O)c1ccc(-n2ncc3ccc(NCc4cccs4)nc32)cc1.
What is the InChIKey of N-(furan-3-ylmethyl)-1-(4-methylsulfonylphenyl)pyrrolo[2,3-b]pyridin-6-amine;methane;3-(4-methylsulfonylphenyl)-N-phenylfuro[3,2-b]pyridin-5-amine;1-(4-methylsulfonylphenyl)-N-(thiophen-2-ylmethyl)pyrazolo[5,4-b]pyridin-6-amine;1-(4-methylsulfonylphenyl)-N-(thiophen-2-ylmethyl)pyrrolo[2,3-b]pyridin-6-amine;7-(4-methylsulfonylphenyl)-N-(thiophen-2-ylmethyl)pyrrolo[2,3-d]pyrimidin-2-amine?
The InChIKey is ZCGXHBATYQAPTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16N2O3S.C19H17N3O3S.C19H17N3O2S2.2C18H16N4O2S2.5CH4/c1-26(23,24)16-9-7-14(8-10-16)17-13-25-18-11-12-19(22-20(17)18)21-15-5-3-2-4-6-15;1-26(23,24)17-5-3-16(4-6-17)22-10-8-15-2-7-18(21-19(15)22)20-12-14-9-11-25-13-14;1-26(23,24)17-7-5-15(6-8-17)22-11-10-14-4-9-18(21-19(14)22)20-13-16-3-2-12-25-16;1-26(23,24)16-7-5-14(6-8-16)22-18-13(11-20-22)4-9-17(21-18)19-12-15-3-2-10-25-15;1-26(23,24)16-6-4-14(5-7-16)22-9-8-13-11-19-18(21-17(13)22)20-12-15-3-2-10-25-15;;;;;/h2-13H,1H3,(H,21,22);2-11,13H,12H2,1H3,(H,20,21);2-12H,13H2,1H3,(H,20,21);2-11H,12H2,1H3,(H,19,21);2-11H,12H2,1H3,(H,19,20,21);5*1H4.
What are the key properties of N-(furan-3-ylmethyl)-1-(4-methylsulfonylphenyl)pyrrolo[2,3-b]pyridin-6-amine;methane;3-(4-methylsulfonylphenyl)-N-phenylfuro[3,2-b]pyridin-5-amine;1-(4-methylsulfonylphenyl)-N-(thiophen-2-ylmethyl)pyrazolo[5,4-b]pyridin-6-amine;1-(4-methylsulfonylphenyl)-N-(thiophen-2-ylmethyl)pyrrolo[2,3-b]pyridin-6-amine;7-(4-methylsulfonylphenyl)-N-(thiophen-2-ylmethyl)pyrrolo[2,3-d]pyrimidin-2-amine?
N-(furan-3-ylmethyl)-1-(4-methylsulfonylphenyl)pyrrolo[2,3-b]pyridin-6-amine;methane;3-(4-methylsulfonylphenyl)-N-phenylfuro[3,2-b]pyridin-5-amine;1-(4-methylsulfonylphenyl)-N-(thiophen-2-ylmethyl)pyrazolo[5,4-b]pyridin-6-amine;1-(4-methylsulfonylphenyl)-N-(thiophen-2-ylmethyl)pyrrolo[2,3-b]pyridin-6-amine;7-(4-methylsulfonylphenyl)-N-(thiophen-2-ylmethyl)pyrrolo[2,3-d]pyrimidin-2-amine has a molecular weight of 1964.54 g/mol, XLogP of 22.55, 24 rotatable bonds, 5 hydrogen bond donors, and 31 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-3-ylmethyl)-1-(4-methylsulfonylphenyl)pyrrolo[2,3-b]pyridin-6-amine;methane;3-(4-methylsulfonylphenyl)-N-phenylfuro[3,2-b]pyridin-5-amine;1-(4-methylsulfonylphenyl)-N-(thiophen-2-ylmethyl)pyrazolo[5,4-b]pyridin-6-amine;1-(4-methylsulfonylphenyl)-N-(thiophen-2-ylmethyl)pyrrolo[2,3-b]pyridin-6-amine;7-(4-methylsulfonylphenyl)-N-(thiophen-2-ylmethyl)pyrrolo[2,3-d]pyrimidin-2-amine is sourced from PubChem (CID 167705898), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).