N-[(1S)-1-(4-cyano-1H-indazol-7-yl)ethyl]-5-(3-cyanophenyl)-6-ethoxy-N-methylpyridine-2-carboxamide;5-(3-cyanophenyl)-4-cyclopropyloxy-N-[(4-fluoro-1H-indazol-7-yl)methyl]-N-methylpyridine-2-carboxamide;6-(3-cyanophenyl)-5-cyclopropyloxy-N-[(4-fluoro-1H-indazol-7-yl)methyl]-N-methylpyridine-3-carboxamide;3-ethoxy-N-[[5-(fluoromethyl)-1H-indazol-7-yl]methyl]-4-(3-fluorophenyl)-N-methylbenzamide;3-ethoxy-4-(3-fluorophenyl)-N-[(5-hydroxy-1H-indazol-7-yl)methyl]-N-methylbenzamide

C125H107F5N22O11 — CID 167596006

IUPACN-[(1S)-1-(4-cyano-1H-indazol-7-yl)ethyl]-5-(3-cyanophenyl)-6-ethoxy-N-methylpyridine-2-carboxamide;5-(3-cyanophenyl)-4-cyclopropyloxy-N-[(4-fluoro-1H-indazol-7-yl)methyl]-N-methylpyridine-2-carboxamide;6-(3-cyanophenyl)-5-cyclopropyloxy-N-[(4-fluoro-1H-indazol-7-yl)methyl]-N-methylpyridine-3-carboxamide;3-ethoxy-N-[[5-(fluoromethyl)-1H-indazol-7-yl]methyl]-4-(3-fluorophenyl)-N-methylbenzamide;3-ethoxy-4-(3-fluorophenyl)-N-[(5-hydroxy-1H-indazol-7-yl)methyl]-N-methylbenzamide
SMILESCCOc1cc(C(=O)N(C)Cc2cc(CF)cc3cn[nH]c23)ccc1-c1cccc(F)c1.CCOc1cc(C(=O)N(C)Cc2cc(O)cc3cn[nH]c23)ccc1-c1cccc(F)c1.CCOc1nc(C(=O)N(C)[C@@H](C)c2ccc(C#N)c3cn[nH]c23)ccc1-c1cccc(C#N)c1.CN(Cc1ccc(F)c2cn[nH]c12)C(=O)c1cc(OC2CC2)c(-c2cccc(C#N)c2)cn1.CN(Cc1ccc(F)c2cn[nH]c12)C(=O)c1cnc(-c2cccc(C#N)c2)c(OC2CC2)c1
InChIInChI=1S/C26H22N6O2.C25H23F2N3O2.2C25H20FN5O2.C24H22FN3O3/c1-4-34-25-21(18-7-5-6-17(12-18)13-27)10-11-23(30-25)26(33)32(3)16(2)20-9-8-19(14-28)22-15-29-31-24(20)22;1-3-32-23-12-18(7-8-22(23)17-5-4-6-21(27)11-17)25(31)30(2)15-20-10-16(13-26)9-19-14-28-29-24(19)20;1-31(14-17-5-8-21(26)20-13-29-30-23(17)20)25(32)18-10-22(33-19-6-7-19)24(28-12-18)16-4-2-3-15(9-16)11-27;1-31(14-17-5-8-21(26)20-13-29-30-24(17)20)25(32)22-10-23(33-18-6-7-18)19(12-28-22)16-4-2-3-15(9-16)11-27;1-3-31-22-12-16(7-8-21(22)15-5-4-6-19(25)9-15)24(30)28(2)14-18-11-20(29)10-17-13-26-27-23(17)18/h5-12,15-16H,4H2,1-3H3,(H,29,31);4-12,14H,3,13,15H2,1-2H3,(H,28,29);2-5,8-10,12-13,19H,6-7,14H2,1H3,(H,29,30);2-5,8-10,12-13,18H,6-7,14H2,1H3,(H,29,30);4-13,29H,3,14H2,1-2H3,(H,26,27)/t16-;;;;/m0..../s1
InChIKeyJBPFZLUIEOKZNK-FXAGWRDUSA-N
MW2188.36 g/mol
LogP23.75
Rot. Bonds31

About N-[(1S)-1-(4-cyano-1H-indazol-7-yl)ethyl]-5-(3-cyanophenyl)-6-ethoxy-N-methylpyridine-2-carboxamide;5-(3-cyanophenyl)-4-cyclopropyloxy-N-[(4-fluoro-1H-indazol-7-yl)methyl]-N-methylpyridine-2-carboxamide;6-(3-cyanophenyl)-5-cyclopropyloxy-N-[(4-fluoro-1H-indazol-7-yl)methyl]-N-methylpyridine-3-carboxamide;3-ethoxy-N-[[5-(fluoromethyl)-1H-indazol-7-yl]methyl]-4-(3-fluorophenyl)-N-methylbenzamide;3-ethoxy-4-(3-fluorophenyl)-N-[(5-hydroxy-1H-indazol-7-yl)methyl]-N-methylbenzamide

N-[(1S)-1-(4-cyano-1H-indazol-7-yl)ethyl]-5-(3-cyanophenyl)-6-ethoxy-N-methylpyridine-2-carboxamide;5-(3-cyanophenyl)-4-cyclopropyloxy-N-[(4-fluoro-1H-indazol-7-yl)methyl]-N-methylpyridine-2-carboxamide;6-(3-cyanophenyl)-5-cyclopropyloxy-N-[(4-fluoro-1H-indazol-7-yl)methyl]-N-methylpyridine-3-carboxamide;3-ethoxy-N-[[5-(fluoromethyl)-1H-indazol-7-yl]methyl]-4-(3-fluorophenyl)-N-methylbenzamide;3-ethoxy-4-(3-fluorophenyl)-N-[(5-hydroxy-1H-indazol-7-yl)methyl]-N-methylbenzamide (PubChem CID 167596006) has the molecular formula C125H107F5N22O11 and a molecular weight of 2188.36 g/mol. Its IUPAC name is N-[(1S)-1-(4-cyano-1H-indazol-7-yl)ethyl]-5-(3-cyanophenyl)-6-ethoxy-N-methylpyridine-2-carboxamide;5-(3-cyanophenyl)-4-cyclopropyloxy-N-[(4-fluoro-1H-indazol-7-yl)methyl]-N-methylpyridine-2-carboxamide;6-(3-cyanophenyl)-5-cyclopropyloxy-N-[(4-fluoro-1H-indazol-7-yl)methyl]-N-methylpyridine-3-carboxamide;3-ethoxy-N-[[5-(fluoromethyl)-1H-indazol-7-yl]methyl]-4-(3-fluorophenyl)-N-methylbenzamide;3-ethoxy-4-(3-fluorophenyl)-N-[(5-hydroxy-1H-indazol-7-yl)methyl]-N-methylbenzamide.

Molecular Properties

Compound NameN-[(1S)-1-(4-cyano-1H-indazol-7-yl)ethyl]-5-(3-cyanophenyl)-6-ethoxy-N-methylpyridine-2-carboxamide;5-(3-cyanophenyl)-4-cyclopropyloxy-N-[(4-fluoro-1H-indazol-7-yl)methyl]-N-methylpyridine-2-carboxamide;6-(3-cyanophenyl)-5-cyclopropyloxy-N-[(4-fluoro-1H-indazol-7-yl)methyl]-N-methylpyridine-3-carboxamide;3-ethoxy-N-[[5-(fluoromethyl)-1H-indazol-7-yl]methyl]-4-(3-fluorophenyl)-N-methylbenzamide;3-ethoxy-4-(3-fluorophenyl)-N-[(5-hydroxy-1H-indazol-7-yl)methyl]-N-methylbenzamide
PubChem CID167596006
Molecular FormulaC125H107F5N22O11
Molecular Weight2188.36 g/mol
Exact Mass2186.84
IUPAC NameN-[(1S)-1-(4-cyano-1H-indazol-7-yl)ethyl]-5-(3-cyanophenyl)-6-ethoxy-N-methylpyridine-2-carboxamide;5-(3-cyanophenyl)-4-cyclopropyloxy-N-[(4-fluoro-1H-indazol-7-yl)methyl]-N-methylpyridine-2-carboxamide;6-(3-cyanophenyl)-5-cyclopropyloxy-N-[(4-fluoro-1H-indazol-7-yl)methyl]-N-methylpyridine-3-carboxamide;3-ethoxy-N-[[5-(fluoromethyl)-1H-indazol-7-yl]methyl]-4-(3-fluorophenyl)-N-methylbenzamide;3-ethoxy-4-(3-fluorophenyl)-N-[(5-hydroxy-1H-indazol-7-yl)methyl]-N-methylbenzamide
SMILESCCOc1cc(C(=O)N(C)Cc2cc(CF)cc3cn[nH]c23)ccc1-c1cccc(F)c1.CCOc1cc(C(=O)N(C)Cc2cc(O)cc3cn[nH]c23)ccc1-c1cccc(F)c1.CCOc1nc(C(=O)N(C)[C@@H](C)c2ccc(C#N)c3cn[nH]c23)ccc1-c1cccc(C#N)c1.CN(Cc1ccc(F)c2cn[nH]c12)C(=O)c1cc(OC2CC2)c(-c2cccc(C#N)c2)cn1.CN(Cc1ccc(F)c2cn[nH]c12)C(=O)c1cnc(-c2cccc(C#N)c2)c(OC2CC2)c1
InChIInChI=1S/C26H22N6O2.C25H23F2N3O2.2C25H20FN5O2.C24H22FN3O3/c1-4-34-25-21(18-7-5-6-17(12-18)13-27)10-11-23(30-25)26(33)32(3)16(2)20-9-8-19(14-28)22-15-29-31-24(20)22;1-3-32-23-12-18(7-8-22(23)17-5-4-6-21(27)11-17)25(31)30(2)15-20-10-16(13-26)9-19-14-28-29-24(19)20;1-31(14-17-5-8-21(26)20-13-29-30-23(17)20)25(32)18-10-22(33-19-6-7-19)24(28-12-18)16-4-2-3-15(9-16)11-27;1-31(14-17-5-8-21(26)20-13-29-30-24(17)20)25(32)22-10-23(33-18-6-7-18)19(12-28-22)16-4-2-3-15(9-16)11-27;1-3-31-22-12-16(7-8-21(22)15-5-4-6-19(25)9-15)24(30)28(2)14-18-11-20(29)10-17-13-26-27-23(17)18/h5-12,15-16H,4H2,1-3H3,(H,29,31);4-12,14H,3,13,15H2,1-2H3,(H,28,29);2-5,8-10,12-13,19H,6-7,14H2,1H3,(H,29,30);2-5,8-10,12-13,18H,6-7,14H2,1H3,(H,29,30);4-13,29H,3,14H2,1-2H3,(H,26,27)/t16-;;;;/m0..../s1
InChIKeyJBPFZLUIEOKZNK-FXAGWRDUSA-N
XLogP23.75
TPSA445.16 Ų
H-Bond Donors6
H-Bond Acceptors23
Rotatable Bonds31
Heavy Atoms163
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002188.36
LogP ≤ 523.75
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1023

Analyze N-[(1S)-1-(4-cyano-1H-indazol-7-yl)ethyl]-5-(3-cyanophenyl)-6-ethoxy-N-methylpyridine-2-carboxamide;5-(3-cyanophenyl)-4-cyclopropyloxy-N-[(4-fluoro-1H-indazol-7-yl)methyl]-N-methylpyridine-2-carboxamide;6-(3-cyanophenyl)-5-cyclopropyloxy-N-[(4-fluoro-1H-indazol-7-yl)methyl]-N-methylpyridine-3-carboxamide;3-ethoxy-N-[[5-(fluoromethyl)-1H-indazol-7-yl]methyl]-4-(3-fluorophenyl)-N-methylbenzamide;3-ethoxy-4-(3-fluorophenyl)-N-[(5-hydroxy-1H-indazol-7-yl)methyl]-N-methylbenzamide with MolForge

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Related Compounds

N-[2-(cyclopropanecarbonylamino)phenyl]-5-[5-[(4-hydroxypiperidin-1-yl)methyl]-3-pyridinyl]-1H-indazole-3-carboxamide;N-[2-(cyclopropanecarbonylamino)phenyl]-5-[5-(morpholin-4-ylmethyl)-3-pyridinyl]-1H-indazole-3-carboxamide;N-[2-(cyclopropanecarbonylamino)phenyl]-5-(5-phenoxy-3-pyridinyl)-1H-indazole-3-carboxamide;5-[5-[(4,4-difluoropiperidin-1-yl)methyl]-3-pyridinyl]-N-(4-hydroxyphenyl)-1H-indazole-3-carboxamide;5-[5-[(3,3-difluoropyrrolidin-1-yl)methyl]-3-pyridinyl]-N-(4-hydroxyphenyl)-1H-indazole-3-carboxamide
CID 160891098
6-cyclopropyloxy-N-methyl-5-phenyl-N-(1H-pyrazolo[4,3-c]pyridin-7-ylmethyl)pyridine-2-carboxamide;3-(1,1-difluoroethoxy)-4-(3-fluorophenyl)-N-methyl-N-(1H-pyrazolo[4,3-c]pyridin-7-ylmethyl)benzamide;3-(1,1-difluoroethoxy)-N-methyl-4-phenyl-N-(1H-pyrazolo[4,3-c]pyridin-7-ylmethyl)benzamide;3-ethoxy-4-ethynyl-N-(1H-indazol-7-ylmethyl)-N-methylbenzamide;3-ethoxy-N-(1H-indazol-7-ylmethyl)-N-methyl-4-prop-1-ynylbenzamide
CID 167560068
5-[4-[(4-cyano-1H-pyrazolo[4,5-c]pyridin-7-yl)methyl-methylcarbamoyl]-2-ethoxyphenyl]-2-fluoro-N-methylbenzamide;5-[2-ethoxy-4-[(4-methoxy-1H-pyrazolo[4,5-c]pyridin-7-yl)methyl-methylcarbamoyl]phenyl]-2-fluoro-N-methylbenzamide;5-ethoxy-N-methyl-N-(1H-pyrazolo[4,3-c]pyridin-7-ylmethyl)-6-[3-(trifluoromethyl)phenyl]pyridine-3-carboxamide;6-(3-fluorophenyl)-N-methyl-5-(oxetan-3-yloxy)-N-(1H-pyrazolo[4,3-c]pyridin-7-ylmethyl)pyridine-3-carboxamide
CID 167626010
4-cyclopropyl-N-(1H-indazol-7-ylmethyl)-N-methyl-3-propoxybenzamide;7-ethoxy-N-(1H-indazol-7-ylmethyl)-N-methyl-1H-indazole-5-carboxamide;3-ethoxy-N-(1H-indazol-7-ylmethyl)-N-methyl-4-(trifluoromethyl)benzamide;N-(1H-indazol-7-ylmethyl)-N-methyl-4-propoxypyridine-2-carboxamide;N-(1H-indazol-7-ylmethyl)-N-methyl-5-propoxypyridine-3-carboxamide
CID 167695586
4-(3-cyanophenyl)-3-cyclopropyloxy-N-[[4-(fluoromethyl)-1H-indazol-7-yl]methyl]-N-methylbenzamide;4-(3-cyanophenyl)-3-(1,1-difluoroethoxy)-N-methyl-N-(1H-pyrazolo[4,3-c]pyridin-7-ylmethyl)benzamide;6-cyclopropyloxy-3-fluoro-N-[(4-fluoro-1H-indazol-7-yl)methyl]-N-methyl-5-phenylpyridine-2-carboxamide;3-cyclopropyloxy-N-[[4-(fluoromethyl)-1H-pyrazolo[4,5-c]pyridin-7-yl]methyl]-4-(3-fluorophenyl)-N-methylbenzamide;6-cyclopropyloxy-5-(3-fluorophenyl)-N-[(4-methoxy-1H-pyrazolo[4,5-c]pyridin-7-yl)methyl]-N-methylpyridine-2-carboxamide;5-[2-ethoxy-4-[[4-(hydroxymethyl)-1H-pyrazolo[4,5-c]pyridin-7-yl]methyl-methylcarbamoyl]phenyl]-2-fluoro-N-methylbenzamide
CID 167701277
4-(3-cyano-5-fluorophenyl)-N-[(5-cyano-1H-indazol-7-yl)methyl]-3-methoxy-N-methylbenzamide;N-[(4-cyano-1H-pyrazolo[4,5-c]pyridin-7-yl)methyl]-3-ethoxy-4-(3-fluorophenyl)-N-methylbenzamide;3-cyclopropyloxy-N-[(4-fluoro-1H-indazol-7-yl)methyl]-4-(3-fluorophenyl)-N-methylbenzamide;3-ethoxy-N-methyl-N-(1H-pyrazolo[4,3-c]pyridin-7-ylmethyl)-4-[3-(trifluoromethyl)phenyl]benzamide
CID 167703908
3-cyano-N-[[6-fluoro-3-(3-fluorophenyl)-1H-indazol-5-yl]methyl]benzamide;3-fluoro-N-[[6-fluoro-3-(3-fluorophenyl)-1H-indazol-5-yl]methyl]benzamide;N-[[6-fluoro-3-(3-fluorophenyl)-1H-indazol-5-yl]methyl]-5-methoxypyridine-3-carboxamide;N-[[6-fluoro-3-(3-fluorophenyl)-1H-indazol-5-yl]methyl]pyridine-3-carboxamide;N-[(6-fluoro-3-naphthalen-2-yl-1H-indazol-5-yl)methyl]-2-methoxybenzamide;N-[(6-fluoro-3-naphthalen-2-yl-1H-indazol-5-yl)methyl]-3-methoxybenzamide
CID 157363441
2-[(3R)-1-[(2-fluoro-6-methoxyphenyl)methyl]piperidin-3-yl]-5-[3-(2-methylindazol-5-yl)-1H-indazol-5-yl]-1,3-oxazole;2-[3-(2-methylindazol-5-yl)-1H-isoindol-5-yl]-5-[(3R)-1-[(1-methylindol-2-yl)methyl]piperidin-3-yl]-1,3,4-oxadiazole;2-[3-(2-methylindazol-5-yl)-1H-isoindol-5-yl]-5-[(3R)-1-[(1-methylindol-3-yl)methyl]piperidin-3-yl]-1,3,4-oxadiazole
CID 158166642
2-[(3R)-1-[(2-fluoro-6-methoxyphenyl)methyl]piperidin-3-yl]-5-[3-(2-methylindazol-5-yl)-1H-indazol-5-yl]-1,3-oxazole;N-[5-[5-[5-[(3R)-1-[(2-fluoro-6-methoxyphenyl)methyl]piperidin-3-yl]-1,3,4-oxadiazol-2-yl]-1H-indazol-3-yl]-2-hydroxyphenyl]acetamide;2-[(3R,5S)-1-[(2-fluorophenyl)methyl]-5-methylpiperidin-3-yl]-5-(3-pyridin-4-yl-1H-indazol-5-yl)-1,3,4-oxadiazole;2-[(3R,5R)-1-[(2-fluorophenyl)methyl]-5-methylpiperidin-3-yl]-5-(3-pyridin-4-yl-1H-indazol-5-yl)-1,3,4-oxadiazole
CID 158978108
3-cyano-N-[[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]methyl]benzamide;N-[[6-fluoro-3-(3-fluorophenyl)-1H-indazol-5-yl]methyl]-3-methoxybenzamide;3-fluoro-N-[[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]methyl]benzamide;N-[[3-(3-fluorophenyl)-4-methoxy-1H-indazol-5-yl]methyl]-3-methoxybenzamide;N-[[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]methyl]-5-methoxypyridine-3-carboxamide;N-[[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]methyl]pyridine-3-carboxamide
CID 159844467
3-cyano-N-[[6-fluoro-3-(3-fluorophenyl)-1H-indazol-5-yl]methyl]benzamide;3-cyano-N-[[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]methyl]benzamide;3-fluoro-N-[[6-fluoro-3-(3-fluorophenyl)-1H-indazol-5-yl]methyl]benzamide;N-[[6-fluoro-3-(3-fluorophenyl)-1H-indazol-5-yl]methyl]-5-methoxypyridine-3-carboxamide;N-[[6-fluoro-3-(3-fluorophenyl)-1H-indazol-5-yl]methyl]pyridine-3-carboxamide;3-fluoro-N-[[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]methyl]benzamide
CID 160350185
5-cyclopropyl-2,3-dimethylpyridine;3,5-dicyclopropyl-2-methylpyridine;3,6-dimethyl-1-benzofuran;2,6-dimethyl-1,3-benzoxazole;2,5-dimethylpyridine;4-fluoro-3,6-dimethyl-2H-indazole;1,3,4,6-tetramethylindazole;2,3,5,6-tetramethylpyridine;3,4,6-trimethyl-1-benzofuran;1,5,7-trimethylindazole;3,4,6-trimethyl-2H-indazole;bis(2,3,5-trimethylpyridine);1,4-xylene
CID 161921348

Frequently Asked Questions

What is the IUPAC name of N-[(1S)-1-(4-cyano-1H-indazol-7-yl)ethyl]-5-(3-cyanophenyl)-6-ethoxy-N-methylpyridine-2-carboxamide;5-(3-cyanophenyl)-4-cyclopropyloxy-N-[(4-fluoro-1H-indazol-7-yl)methyl]-N-methylpyridine-2-carboxamide;6-(3-cyanophenyl)-5-cyclopropyloxy-N-[(4-fluoro-1H-indazol-7-yl)methyl]-N-methylpyridine-3-carboxamide;3-ethoxy-N-[[5-(fluoromethyl)-1H-indazol-7-yl]methyl]-4-(3-fluorophenyl)-N-methylbenzamide;3-ethoxy-4-(3-fluorophenyl)-N-[(5-hydroxy-1H-indazol-7-yl)methyl]-N-methylbenzamide?
The IUPAC name of N-[(1S)-1-(4-cyano-1H-indazol-7-yl)ethyl]-5-(3-cyanophenyl)-6-ethoxy-N-methylpyridine-2-carboxamide;5-(3-cyanophenyl)-4-cyclopropyloxy-N-[(4-fluoro-1H-indazol-7-yl)methyl]-N-methylpyridine-2-carboxamide;6-(3-cyanophenyl)-5-cyclopropyloxy-N-[(4-fluoro-1H-indazol-7-yl)methyl]-N-methylpyridine-3-carboxamide;3-ethoxy-N-[[5-(fluoromethyl)-1H-indazol-7-yl]methyl]-4-(3-fluorophenyl)-N-methylbenzamide;3-ethoxy-4-(3-fluorophenyl)-N-[(5-hydroxy-1H-indazol-7-yl)methyl]-N-methylbenzamide (CID 167596006) is N-[(1S)-1-(4-cyano-1H-indazol-7-yl)ethyl]-5-(3-cyanophenyl)-6-ethoxy-N-methylpyridine-2-carboxamide;5-(3-cyanophenyl)-4-cyclopropyloxy-N-[(4-fluoro-1H-indazol-7-yl)methyl]-N-methylpyridine-2-carboxamide;6-(3-cyanophenyl)-5-cyclopropyloxy-N-[(4-fluoro-1H-indazol-7-yl)methyl]-N-methylpyridine-3-carboxamide;3-ethoxy-N-[[5-(fluoromethyl)-1H-indazol-7-yl]methyl]-4-(3-fluorophenyl)-N-methylbenzamide;3-ethoxy-4-(3-fluorophenyl)-N-[(5-hydroxy-1H-indazol-7-yl)methyl]-N-methylbenzamide.
What is the SMILES notation for N-[(1S)-1-(4-cyano-1H-indazol-7-yl)ethyl]-5-(3-cyanophenyl)-6-ethoxy-N-methylpyridine-2-carboxamide;5-(3-cyanophenyl)-4-cyclopropyloxy-N-[(4-fluoro-1H-indazol-7-yl)methyl]-N-methylpyridine-2-carboxamide;6-(3-cyanophenyl)-5-cyclopropyloxy-N-[(4-fluoro-1H-indazol-7-yl)methyl]-N-methylpyridine-3-carboxamide;3-ethoxy-N-[[5-(fluoromethyl)-1H-indazol-7-yl]methyl]-4-(3-fluorophenyl)-N-methylbenzamide;3-ethoxy-4-(3-fluorophenyl)-N-[(5-hydroxy-1H-indazol-7-yl)methyl]-N-methylbenzamide?
The canonical SMILES for N-[(1S)-1-(4-cyano-1H-indazol-7-yl)ethyl]-5-(3-cyanophenyl)-6-ethoxy-N-methylpyridine-2-carboxamide;5-(3-cyanophenyl)-4-cyclopropyloxy-N-[(4-fluoro-1H-indazol-7-yl)methyl]-N-methylpyridine-2-carboxamide;6-(3-cyanophenyl)-5-cyclopropyloxy-N-[(4-fluoro-1H-indazol-7-yl)methyl]-N-methylpyridine-3-carboxamide;3-ethoxy-N-[[5-(fluoromethyl)-1H-indazol-7-yl]methyl]-4-(3-fluorophenyl)-N-methylbenzamide;3-ethoxy-4-(3-fluorophenyl)-N-[(5-hydroxy-1H-indazol-7-yl)methyl]-N-methylbenzamide is CCOc1cc(C(=O)N(C)Cc2cc(CF)cc3cn[nH]c23)ccc1-c1cccc(F)c1.CCOc1cc(C(=O)N(C)Cc2cc(O)cc3cn[nH]c23)ccc1-c1cccc(F)c1.CCOc1nc(C(=O)N(C)[C@@H](C)c2ccc(C#N)c3cn[nH]c23)ccc1-c1cccc(C#N)c1.CN(Cc1ccc(F)c2cn[nH]c12)C(=O)c1cc(OC2CC2)c(-c2cccc(C#N)c2)cn1.CN(Cc1ccc(F)c2cn[nH]c12)C(=O)c1cnc(-c2cccc(C#N)c2)c(OC2CC2)c1.
What is the InChIKey of N-[(1S)-1-(4-cyano-1H-indazol-7-yl)ethyl]-5-(3-cyanophenyl)-6-ethoxy-N-methylpyridine-2-carboxamide;5-(3-cyanophenyl)-4-cyclopropyloxy-N-[(4-fluoro-1H-indazol-7-yl)methyl]-N-methylpyridine-2-carboxamide;6-(3-cyanophenyl)-5-cyclopropyloxy-N-[(4-fluoro-1H-indazol-7-yl)methyl]-N-methylpyridine-3-carboxamide;3-ethoxy-N-[[5-(fluoromethyl)-1H-indazol-7-yl]methyl]-4-(3-fluorophenyl)-N-methylbenzamide;3-ethoxy-4-(3-fluorophenyl)-N-[(5-hydroxy-1H-indazol-7-yl)methyl]-N-methylbenzamide?
The InChIKey is JBPFZLUIEOKZNK-FXAGWRDUSA-N. The full InChI is InChI=1S/C26H22N6O2.C25H23F2N3O2.2C25H20FN5O2.C24H22FN3O3/c1-4-34-25-21(18-7-5-6-17(12-18)13-27)10-11-23(30-25)26(33)32(3)16(2)20-9-8-19(14-28)22-15-29-31-24(20)22;1-3-32-23-12-18(7-8-22(23)17-5-4-6-21(27)11-17)25(31)30(2)15-20-10-16(13-26)9-19-14-28-29-24(19)20;1-31(14-17-5-8-21(26)20-13-29-30-23(17)20)25(32)18-10-22(33-19-6-7-19)24(28-12-18)16-4-2-3-15(9-16)11-27;1-31(14-17-5-8-21(26)20-13-29-30-24(17)20)25(32)22-10-23(33-18-6-7-18)19(12-28-22)16-4-2-3-15(9-16)11-27;1-3-31-22-12-16(7-8-21(22)15-5-4-6-19(25)9-15)24(30)28(2)14-18-11-20(29)10-17-13-26-27-23(17)18/h5-12,15-16H,4H2,1-3H3,(H,29,31);4-12,14H,3,13,15H2,1-2H3,(H,28,29);2-5,8-10,12-13,19H,6-7,14H2,1H3,(H,29,30);2-5,8-10,12-13,18H,6-7,14H2,1H3,(H,29,30);4-13,29H,3,14H2,1-2H3,(H,26,27)/t16-;;;;/m0..../s1.
What are the key properties of N-[(1S)-1-(4-cyano-1H-indazol-7-yl)ethyl]-5-(3-cyanophenyl)-6-ethoxy-N-methylpyridine-2-carboxamide;5-(3-cyanophenyl)-4-cyclopropyloxy-N-[(4-fluoro-1H-indazol-7-yl)methyl]-N-methylpyridine-2-carboxamide;6-(3-cyanophenyl)-5-cyclopropyloxy-N-[(4-fluoro-1H-indazol-7-yl)methyl]-N-methylpyridine-3-carboxamide;3-ethoxy-N-[[5-(fluoromethyl)-1H-indazol-7-yl]methyl]-4-(3-fluorophenyl)-N-methylbenzamide;3-ethoxy-4-(3-fluorophenyl)-N-[(5-hydroxy-1H-indazol-7-yl)methyl]-N-methylbenzamide?
N-[(1S)-1-(4-cyano-1H-indazol-7-yl)ethyl]-5-(3-cyanophenyl)-6-ethoxy-N-methylpyridine-2-carboxamide;5-(3-cyanophenyl)-4-cyclopropyloxy-N-[(4-fluoro-1H-indazol-7-yl)methyl]-N-methylpyridine-2-carboxamide;6-(3-cyanophenyl)-5-cyclopropyloxy-N-[(4-fluoro-1H-indazol-7-yl)methyl]-N-methylpyridine-3-carboxamide;3-ethoxy-N-[[5-(fluoromethyl)-1H-indazol-7-yl]methyl]-4-(3-fluorophenyl)-N-methylbenzamide;3-ethoxy-4-(3-fluorophenyl)-N-[(5-hydroxy-1H-indazol-7-yl)methyl]-N-methylbenzamide has a molecular weight of 2188.36 g/mol, XLogP of 23.75, 31 rotatable bonds, 6 hydrogen bond donors, and 23 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1S)-1-(4-cyano-1H-indazol-7-yl)ethyl]-5-(3-cyanophenyl)-6-ethoxy-N-methylpyridine-2-carboxamide;5-(3-cyanophenyl)-4-cyclopropyloxy-N-[(4-fluoro-1H-indazol-7-yl)methyl]-N-methylpyridine-2-carboxamide;6-(3-cyanophenyl)-5-cyclopropyloxy-N-[(4-fluoro-1H-indazol-7-yl)methyl]-N-methylpyridine-3-carboxamide;3-ethoxy-N-[[5-(fluoromethyl)-1H-indazol-7-yl]methyl]-4-(3-fluorophenyl)-N-methylbenzamide;3-ethoxy-4-(3-fluorophenyl)-N-[(5-hydroxy-1H-indazol-7-yl)methyl]-N-methylbenzamide is sourced from PubChem (CID 167596006), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).