5-cyano-2-(3,3-difluoropiperidin-1-yl)-N-[(3-thiophen-2-yl-1H-pyrazol-5-yl)methyl]benzamide;5-cyano-2-pyrrolidin-1-yl-N-[(3-thiophen-2-yl-1H-pyrazol-5-yl)methyl]benzamide;3-(3,3-difluoroazetidin-1-yl)-N-[(3-thiophen-2-yl-1H-1,2,4-triazol-5-yl)methyl]pyrazine-2-carboxamide;2-(3,3-difluoropiperidin-1-yl)-5-hydroxy-N-[(3-thiophen-2-yl-1H-pyrazol-5-yl)methyl]benzamide;5-fluoro-2-piperidin-1-yl-N-[(3-thiophen-2-yl-1H-pyrazol-5-yl)methyl]benzamide;2-pyrrolidin-1-yl-N-[(3-thiophen-2-yl-1H-pyrazol-5-yl)methyl]-3-(trifluoromethyl)benzamide;2-pyrrolidin-1-yl-N-[(3-thiophen-2-yl-1H-pyrazol-5-yl)methyl]-5-(trifluoromethyl)benzamide

C136H130F13N33O8S7 — CID 163918738

IUPAC5-cyano-2-(3,3-difluoropiperidin-1-yl)-N-[(3-thiophen-2-yl-1H-pyrazol-5-yl)methyl]benzamide;5-cyano-2-pyrrolidin-1-yl-N-[(3-thiophen-2-yl-1H-pyrazol-5-yl)methyl]benzamide;3-(3,3-difluoroazetidin-1-yl)-N-[(3-thiophen-2-yl-1H-1,2,4-triazol-5-yl)methyl]pyrazine-2-carboxamide;2-(3,3-difluoropiperidin-1-yl)-5-hydroxy-N-[(3-thiophen-2-yl-1H-pyrazol-5-yl)methyl]benzamide;5-fluoro-2-piperidin-1-yl-N-[(3-thiophen-2-yl-1H-pyrazol-5-yl)methyl]benzamide;2-pyrrolidin-1-yl-N-[(3-thiophen-2-yl-1H-pyrazol-5-yl)methyl]-3-(trifluoromethyl)benzamide;2-pyrrolidin-1-yl-N-[(3-thiophen-2-yl-1H-pyrazol-5-yl)methyl]-5-(trifluoromethyl)benzamide
SMILESN#Cc1ccc(N2CCCC(F)(F)C2)c(C(=O)NCc2cc(-c3cccs3)n[nH]2)c1.N#Cc1ccc(N2CCCC2)c(C(=O)NCc2cc(-c3cccs3)n[nH]2)c1.O=C(NCc1cc(-c2cccs2)n[nH]1)c1cc(C(F)(F)F)ccc1N1CCCC1.O=C(NCc1cc(-c2cccs2)n[nH]1)c1cc(F)ccc1N1CCCCC1.O=C(NCc1cc(-c2cccs2)n[nH]1)c1cc(O)ccc1N1CCCC(F)(F)C1.O=C(NCc1cc(-c2cccs2)n[nH]1)c1cccc(C(F)(F)F)c1N1CCCC1.O=C(NCc1nc(-c2cccs2)n[nH]1)c1nccnc1N1CC(F)(F)C1
InChIInChI=1S/C21H19F2N5OS.2C20H19F3N4OS.C20H20F2N4O2S.C20H21FN4OS.C20H19N5OS.C15H13F2N7OS/c22-21(23)6-2-7-28(13-21)18-5-4-14(11-24)9-16(18)20(29)25-12-15-10-17(27-26-15)19-3-1-8-30-19;21-20(22,23)15-6-3-5-14(18(15)27-8-1-2-9-27)19(28)24-12-13-11-16(26-25-13)17-7-4-10-29-17;21-20(22,23)13-5-6-17(27-7-1-2-8-27)15(10-13)19(28)24-12-14-11-16(26-25-14)18-4-3-9-29-18;21-20(22)6-2-7-26(12-20)17-5-4-14(27)10-15(17)19(28)23-11-13-9-16(25-24-13)18-3-1-8-29-18;21-14-6-7-18(25-8-2-1-3-9-25)16(11-14)20(26)22-13-15-12-17(24-23-15)19-5-4-10-27-19;21-12-14-5-6-18(25-7-1-2-8-25)16(10-14)20(26)22-13-15-11-17(24-23-15)19-4-3-9-27-19;16-15(17)7-24(8-15)13-11(18-3-4-19-13)14(25)20-6-10-21-12(23-22-10)9-2-1-5-26-9/h1,3-5,8-10H,2,6-7,12-13H2,(H,25,29)(H,26,27);3-7,10-11H,1-2,8-9,12H2,(H,24,28)(H,25,26);3-6,9-11H,1-2,7-8,12H2,(H,24,28)(H,25,26);1,3-5,8-10,27H,2,6-7,11-12H2,(H,23,28)(H,24,25);4-7,10-12H,1-3,8-9,13H2,(H,22,26)(H,23,24);3-6,9-11H,1-2,7-8,13H2,(H,22,26)(H,23,24);1-5H,6-8H2,(H,20,25)(H,21,22,23)
InChIKeyQYOHQFYPNUXTJM-UHFFFAOYSA-N
MW2826.20 g/mol
LogP27.01
Rot. Bonds35

About 5-cyano-2-(3,3-difluoropiperidin-1-yl)-N-[(3-thiophen-2-yl-1H-pyrazol-5-yl)methyl]benzamide;5-cyano-2-pyrrolidin-1-yl-N-[(3-thiophen-2-yl-1H-pyrazol-5-yl)methyl]benzamide;3-(3,3-difluoroazetidin-1-yl)-N-[(3-thiophen-2-yl-1H-1,2,4-triazol-5-yl)methyl]pyrazine-2-carboxamide;2-(3,3-difluoropiperidin-1-yl)-5-hydroxy-N-[(3-thiophen-2-yl-1H-pyrazol-5-yl)methyl]benzamide;5-fluoro-2-piperidin-1-yl-N-[(3-thiophen-2-yl-1H-pyrazol-5-yl)methyl]benzamide;2-pyrrolidin-1-yl-N-[(3-thiophen-2-yl-1H-pyrazol-5-yl)methyl]-3-(trifluoromethyl)benzamide;2-pyrrolidin-1-yl-N-[(3-thiophen-2-yl-1H-pyrazol-5-yl)methyl]-5-(trifluoromethyl)benzamide

5-cyano-2-(3,3-difluoropiperidin-1-yl)-N-[(3-thiophen-2-yl-1H-pyrazol-5-yl)methyl]benzamide;5-cyano-2-pyrrolidin-1-yl-N-[(3-thiophen-2-yl-1H-pyrazol-5-yl)methyl]benzamide;3-(3,3-difluoroazetidin-1-yl)-N-[(3-thiophen-2-yl-1H-1,2,4-triazol-5-yl)methyl]pyrazine-2-carboxamide;2-(3,3-difluoropiperidin-1-yl)-5-hydroxy-N-[(3-thiophen-2-yl-1H-pyrazol-5-yl)methyl]benzamide;5-fluoro-2-piperidin-1-yl-N-[(3-thiophen-2-yl-1H-pyrazol-5-yl)methyl]benzamide;2-pyrrolidin-1-yl-N-[(3-thiophen-2-yl-1H-pyrazol-5-yl)methyl]-3-(trifluoromethyl)benzamide;2-pyrrolidin-1-yl-N-[(3-thiophen-2-yl-1H-pyrazol-5-yl)methyl]-5-(trifluoromethyl)benzamide (PubChem CID 163918738) has the molecular formula C136H130F13N33O8S7 and a molecular weight of 2826.20 g/mol. Its IUPAC name is 5-cyano-2-(3,3-difluoropiperidin-1-yl)-N-[(3-thiophen-2-yl-1H-pyrazol-5-yl)methyl]benzamide;5-cyano-2-pyrrolidin-1-yl-N-[(3-thiophen-2-yl-1H-pyrazol-5-yl)methyl]benzamide;3-(3,3-difluoroazetidin-1-yl)-N-[(3-thiophen-2-yl-1H-1,2,4-triazol-5-yl)methyl]pyrazine-2-carboxamide;2-(3,3-difluoropiperidin-1-yl)-5-hydroxy-N-[(3-thiophen-2-yl-1H-pyrazol-5-yl)methyl]benzamide;5-fluoro-2-piperidin-1-yl-N-[(3-thiophen-2-yl-1H-pyrazol-5-yl)methyl]benzamide;2-pyrrolidin-1-yl-N-[(3-thiophen-2-yl-1H-pyrazol-5-yl)methyl]-3-(trifluoromethyl)benzamide;2-pyrrolidin-1-yl-N-[(3-thiophen-2-yl-1H-pyrazol-5-yl)methyl]-5-(trifluoromethyl)benzamide.

Molecular Properties

Compound Name5-cyano-2-(3,3-difluoropiperidin-1-yl)-N-[(3-thiophen-2-yl-1H-pyrazol-5-yl)methyl]benzamide;5-cyano-2-pyrrolidin-1-yl-N-[(3-thiophen-2-yl-1H-pyrazol-5-yl)methyl]benzamide;3-(3,3-difluoroazetidin-1-yl)-N-[(3-thiophen-2-yl-1H-1,2,4-triazol-5-yl)methyl]pyrazine-2-carboxamide;2-(3,3-difluoropiperidin-1-yl)-5-hydroxy-N-[(3-thiophen-2-yl-1H-pyrazol-5-yl)methyl]benzamide;5-fluoro-2-piperidin-1-yl-N-[(3-thiophen-2-yl-1H-pyrazol-5-yl)methyl]benzamide;2-pyrrolidin-1-yl-N-[(3-thiophen-2-yl-1H-pyrazol-5-yl)methyl]-3-(trifluoromethyl)benzamide;2-pyrrolidin-1-yl-N-[(3-thiophen-2-yl-1H-pyrazol-5-yl)methyl]-5-(trifluoromethyl)benzamide
PubChem CID163918738
Molecular FormulaC136H130F13N33O8S7
Molecular Weight2826.20 g/mol
Exact Mass2823.86
IUPAC Name5-cyano-2-(3,3-difluoropiperidin-1-yl)-N-[(3-thiophen-2-yl-1H-pyrazol-5-yl)methyl]benzamide;5-cyano-2-pyrrolidin-1-yl-N-[(3-thiophen-2-yl-1H-pyrazol-5-yl)methyl]benzamide;3-(3,3-difluoroazetidin-1-yl)-N-[(3-thiophen-2-yl-1H-1,2,4-triazol-5-yl)methyl]pyrazine-2-carboxamide;2-(3,3-difluoropiperidin-1-yl)-5-hydroxy-N-[(3-thiophen-2-yl-1H-pyrazol-5-yl)methyl]benzamide;5-fluoro-2-piperidin-1-yl-N-[(3-thiophen-2-yl-1H-pyrazol-5-yl)methyl]benzamide;2-pyrrolidin-1-yl-N-[(3-thiophen-2-yl-1H-pyrazol-5-yl)methyl]-3-(trifluoromethyl)benzamide;2-pyrrolidin-1-yl-N-[(3-thiophen-2-yl-1H-pyrazol-5-yl)methyl]-5-(trifluoromethyl)benzamide
SMILESN#Cc1ccc(N2CCCC(F)(F)C2)c(C(=O)NCc2cc(-c3cccs3)n[nH]2)c1.N#Cc1ccc(N2CCCC2)c(C(=O)NCc2cc(-c3cccs3)n[nH]2)c1.O=C(NCc1cc(-c2cccs2)n[nH]1)c1cc(C(F)(F)F)ccc1N1CCCC1.O=C(NCc1cc(-c2cccs2)n[nH]1)c1cc(F)ccc1N1CCCCC1.O=C(NCc1cc(-c2cccs2)n[nH]1)c1cc(O)ccc1N1CCCC(F)(F)C1.O=C(NCc1cc(-c2cccs2)n[nH]1)c1cccc(C(F)(F)F)c1N1CCCC1.O=C(NCc1nc(-c2cccs2)n[nH]1)c1nccnc1N1CC(F)(F)C1
InChIInChI=1S/C21H19F2N5OS.2C20H19F3N4OS.C20H20F2N4O2S.C20H21FN4OS.C20H19N5OS.C15H13F2N7OS/c22-21(23)6-2-7-28(13-21)18-5-4-14(11-24)9-16(18)20(29)25-12-15-10-17(27-26-15)19-3-1-8-30-19;21-20(22,23)15-6-3-5-14(18(15)27-8-1-2-9-27)19(28)24-12-13-11-16(26-25-13)17-7-4-10-29-17;21-20(22,23)13-5-6-17(27-7-1-2-8-27)15(10-13)19(28)24-12-14-11-16(26-25-14)18-4-3-9-29-18;21-20(22)6-2-7-26(12-20)17-5-4-14(27)10-15(17)19(28)23-11-13-9-16(25-24-13)18-3-1-8-29-18;21-14-6-7-18(25-8-2-1-3-9-25)16(11-14)20(26)22-13-15-12-17(24-23-15)19-5-4-10-27-19;21-12-14-5-6-18(25-7-1-2-8-25)16(10-14)20(26)22-13-15-11-17(24-23-15)19-4-3-9-27-19;16-15(17)7-24(8-15)13-11(18-3-4-19-13)14(25)20-6-10-21-12(23-22-10)9-2-1-5-26-9/h1,3-5,8-10H,2,6-7,12-13H2,(H,25,29)(H,26,27);3-7,10-11H,1-2,8-9,12H2,(H,24,28)(H,25,26);3-6,9-11H,1-2,7-8,12H2,(H,24,28)(H,25,26);1,3-5,8-10,27H,2,6-7,11-12H2,(H,23,28)(H,24,25);4-7,10-12H,1-3,8-9,13H2,(H,22,26)(H,23,24);3-6,9-11H,1-2,7-8,13H2,(H,22,26)(H,23,24);1-5H,6-8H2,(H,20,25)(H,21,22,23)
InChIKeyQYOHQFYPNUXTJM-UHFFFAOYSA-N
XLogP27.01
TPSA533.62 Ų
H-Bond Donors15
H-Bond Acceptors34
Rotatable Bonds35
Heavy Atoms197
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002826.20
LogP ≤ 527.01
H-Bond Donors ≤ 515
H-Bond Acceptors ≤ 1034

Analyze 5-cyano-2-(3,3-difluoropiperidin-1-yl)-N-[(3-thiophen-2-yl-1H-pyrazol-5-yl)methyl]benzamide;5-cyano-2-pyrrolidin-1-yl-N-[(3-thiophen-2-yl-1H-pyrazol-5-yl)methyl]benzamide;3-(3,3-difluoroazetidin-1-yl)-N-[(3-thiophen-2-yl-1H-1,2,4-triazol-5-yl)methyl]pyrazine-2-carboxamide;2-(3,3-difluoropiperidin-1-yl)-5-hydroxy-N-[(3-thiophen-2-yl-1H-pyrazol-5-yl)methyl]benzamide;5-fluoro-2-piperidin-1-yl-N-[(3-thiophen-2-yl-1H-pyrazol-5-yl)methyl]benzamide;2-pyrrolidin-1-yl-N-[(3-thiophen-2-yl-1H-pyrazol-5-yl)methyl]-3-(trifluoromethyl)benzamide;2-pyrrolidin-1-yl-N-[(3-thiophen-2-yl-1H-pyrazol-5-yl)methyl]-5-(trifluoromethyl)benzamide with MolForge

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Related Compounds

2-(3,3-difluoroazetidin-1-yl)-N-[(3-thiophen-2-yl-1H-pyrazol-5-yl)methyl]pyridine-3-carboxamide;3-(3,3-difluoropiperidin-1-yl)-N-[(3-thiophen-2-yl-1H-1,2,4-triazol-5-yl)methyl]pyrazine-2-carboxamide;3-(4,4-difluoropiperidin-1-yl)-N-[(3-thiophen-2-yl-1H-1,2,4-triazol-5-yl)methyl]pyrazine-2-carboxamide;3-(3,3-difluoropyrrolidin-1-yl)-N-[(3-thiophen-2-yl-1H-1,2,4-triazol-5-yl)methyl]pyrazine-2-carboxamide;N-[[3-(2-ethoxy-5-methylphenyl)-1H-pyrazol-5-yl]methyl]-5-fluoro-2-pyrrolidin-1-ylbenzamide;5-fluoro-N-[[3-(5-fluoro-2-hydroxyphenyl)-1H-pyrazol-5-yl]methyl]-2-piperidin-1-ylbenzamide;5-fluoro-N-[[3-(5-methyl-2-propan-2-yloxyphenyl)-1H-pyrazol-5-yl]methyl]-2-piperidin-1-ylbenzamide
CID 163905182

Frequently Asked Questions

What is the IUPAC name of 5-cyano-2-(3,3-difluoropiperidin-1-yl)-N-[(3-thiophen-2-yl-1H-pyrazol-5-yl)methyl]benzamide;5-cyano-2-pyrrolidin-1-yl-N-[(3-thiophen-2-yl-1H-pyrazol-5-yl)methyl]benzamide;3-(3,3-difluoroazetidin-1-yl)-N-[(3-thiophen-2-yl-1H-1,2,4-triazol-5-yl)methyl]pyrazine-2-carboxamide;2-(3,3-difluoropiperidin-1-yl)-5-hydroxy-N-[(3-thiophen-2-yl-1H-pyrazol-5-yl)methyl]benzamide;5-fluoro-2-piperidin-1-yl-N-[(3-thiophen-2-yl-1H-pyrazol-5-yl)methyl]benzamide;2-pyrrolidin-1-yl-N-[(3-thiophen-2-yl-1H-pyrazol-5-yl)methyl]-3-(trifluoromethyl)benzamide;2-pyrrolidin-1-yl-N-[(3-thiophen-2-yl-1H-pyrazol-5-yl)methyl]-5-(trifluoromethyl)benzamide?
The IUPAC name of 5-cyano-2-(3,3-difluoropiperidin-1-yl)-N-[(3-thiophen-2-yl-1H-pyrazol-5-yl)methyl]benzamide;5-cyano-2-pyrrolidin-1-yl-N-[(3-thiophen-2-yl-1H-pyrazol-5-yl)methyl]benzamide;3-(3,3-difluoroazetidin-1-yl)-N-[(3-thiophen-2-yl-1H-1,2,4-triazol-5-yl)methyl]pyrazine-2-carboxamide;2-(3,3-difluoropiperidin-1-yl)-5-hydroxy-N-[(3-thiophen-2-yl-1H-pyrazol-5-yl)methyl]benzamide;5-fluoro-2-piperidin-1-yl-N-[(3-thiophen-2-yl-1H-pyrazol-5-yl)methyl]benzamide;2-pyrrolidin-1-yl-N-[(3-thiophen-2-yl-1H-pyrazol-5-yl)methyl]-3-(trifluoromethyl)benzamide;2-pyrrolidin-1-yl-N-[(3-thiophen-2-yl-1H-pyrazol-5-yl)methyl]-5-(trifluoromethyl)benzamide (CID 163918738) is 5-cyano-2-(3,3-difluoropiperidin-1-yl)-N-[(3-thiophen-2-yl-1H-pyrazol-5-yl)methyl]benzamide;5-cyano-2-pyrrolidin-1-yl-N-[(3-thiophen-2-yl-1H-pyrazol-5-yl)methyl]benzamide;3-(3,3-difluoroazetidin-1-yl)-N-[(3-thiophen-2-yl-1H-1,2,4-triazol-5-yl)methyl]pyrazine-2-carboxamide;2-(3,3-difluoropiperidin-1-yl)-5-hydroxy-N-[(3-thiophen-2-yl-1H-pyrazol-5-yl)methyl]benzamide;5-fluoro-2-piperidin-1-yl-N-[(3-thiophen-2-yl-1H-pyrazol-5-yl)methyl]benzamide;2-pyrrolidin-1-yl-N-[(3-thiophen-2-yl-1H-pyrazol-5-yl)methyl]-3-(trifluoromethyl)benzamide;2-pyrrolidin-1-yl-N-[(3-thiophen-2-yl-1H-pyrazol-5-yl)methyl]-5-(trifluoromethyl)benzamide.
What is the SMILES notation for 5-cyano-2-(3,3-difluoropiperidin-1-yl)-N-[(3-thiophen-2-yl-1H-pyrazol-5-yl)methyl]benzamide;5-cyano-2-pyrrolidin-1-yl-N-[(3-thiophen-2-yl-1H-pyrazol-5-yl)methyl]benzamide;3-(3,3-difluoroazetidin-1-yl)-N-[(3-thiophen-2-yl-1H-1,2,4-triazol-5-yl)methyl]pyrazine-2-carboxamide;2-(3,3-difluoropiperidin-1-yl)-5-hydroxy-N-[(3-thiophen-2-yl-1H-pyrazol-5-yl)methyl]benzamide;5-fluoro-2-piperidin-1-yl-N-[(3-thiophen-2-yl-1H-pyrazol-5-yl)methyl]benzamide;2-pyrrolidin-1-yl-N-[(3-thiophen-2-yl-1H-pyrazol-5-yl)methyl]-3-(trifluoromethyl)benzamide;2-pyrrolidin-1-yl-N-[(3-thiophen-2-yl-1H-pyrazol-5-yl)methyl]-5-(trifluoromethyl)benzamide?
The canonical SMILES for 5-cyano-2-(3,3-difluoropiperidin-1-yl)-N-[(3-thiophen-2-yl-1H-pyrazol-5-yl)methyl]benzamide;5-cyano-2-pyrrolidin-1-yl-N-[(3-thiophen-2-yl-1H-pyrazol-5-yl)methyl]benzamide;3-(3,3-difluoroazetidin-1-yl)-N-[(3-thiophen-2-yl-1H-1,2,4-triazol-5-yl)methyl]pyrazine-2-carboxamide;2-(3,3-difluoropiperidin-1-yl)-5-hydroxy-N-[(3-thiophen-2-yl-1H-pyrazol-5-yl)methyl]benzamide;5-fluoro-2-piperidin-1-yl-N-[(3-thiophen-2-yl-1H-pyrazol-5-yl)methyl]benzamide;2-pyrrolidin-1-yl-N-[(3-thiophen-2-yl-1H-pyrazol-5-yl)methyl]-3-(trifluoromethyl)benzamide;2-pyrrolidin-1-yl-N-[(3-thiophen-2-yl-1H-pyrazol-5-yl)methyl]-5-(trifluoromethyl)benzamide is N#Cc1ccc(N2CCCC(F)(F)C2)c(C(=O)NCc2cc(-c3cccs3)n[nH]2)c1.N#Cc1ccc(N2CCCC2)c(C(=O)NCc2cc(-c3cccs3)n[nH]2)c1.O=C(NCc1cc(-c2cccs2)n[nH]1)c1cc(C(F)(F)F)ccc1N1CCCC1.O=C(NCc1cc(-c2cccs2)n[nH]1)c1cc(F)ccc1N1CCCCC1.O=C(NCc1cc(-c2cccs2)n[nH]1)c1cc(O)ccc1N1CCCC(F)(F)C1.O=C(NCc1cc(-c2cccs2)n[nH]1)c1cccc(C(F)(F)F)c1N1CCCC1.O=C(NCc1nc(-c2cccs2)n[nH]1)c1nccnc1N1CC(F)(F)C1.
What is the InChIKey of 5-cyano-2-(3,3-difluoropiperidin-1-yl)-N-[(3-thiophen-2-yl-1H-pyrazol-5-yl)methyl]benzamide;5-cyano-2-pyrrolidin-1-yl-N-[(3-thiophen-2-yl-1H-pyrazol-5-yl)methyl]benzamide;3-(3,3-difluoroazetidin-1-yl)-N-[(3-thiophen-2-yl-1H-1,2,4-triazol-5-yl)methyl]pyrazine-2-carboxamide;2-(3,3-difluoropiperidin-1-yl)-5-hydroxy-N-[(3-thiophen-2-yl-1H-pyrazol-5-yl)methyl]benzamide;5-fluoro-2-piperidin-1-yl-N-[(3-thiophen-2-yl-1H-pyrazol-5-yl)methyl]benzamide;2-pyrrolidin-1-yl-N-[(3-thiophen-2-yl-1H-pyrazol-5-yl)methyl]-3-(trifluoromethyl)benzamide;2-pyrrolidin-1-yl-N-[(3-thiophen-2-yl-1H-pyrazol-5-yl)methyl]-5-(trifluoromethyl)benzamide?
The InChIKey is QYOHQFYPNUXTJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19F2N5OS.2C20H19F3N4OS.C20H20F2N4O2S.C20H21FN4OS.C20H19N5OS.C15H13F2N7OS/c22-21(23)6-2-7-28(13-21)18-5-4-14(11-24)9-16(18)20(29)25-12-15-10-17(27-26-15)19-3-1-8-30-19;21-20(22,23)15-6-3-5-14(18(15)27-8-1-2-9-27)19(28)24-12-13-11-16(26-25-13)17-7-4-10-29-17;21-20(22,23)13-5-6-17(27-7-1-2-8-27)15(10-13)19(28)24-12-14-11-16(26-25-14)18-4-3-9-29-18;21-20(22)6-2-7-26(12-20)17-5-4-14(27)10-15(17)19(28)23-11-13-9-16(25-24-13)18-3-1-8-29-18;21-14-6-7-18(25-8-2-1-3-9-25)16(11-14)20(26)22-13-15-12-17(24-23-15)19-5-4-10-27-19;21-12-14-5-6-18(25-7-1-2-8-25)16(10-14)20(26)22-13-15-11-17(24-23-15)19-4-3-9-27-19;16-15(17)7-24(8-15)13-11(18-3-4-19-13)14(25)20-6-10-21-12(23-22-10)9-2-1-5-26-9/h1,3-5,8-10H,2,6-7,12-13H2,(H,25,29)(H,26,27);3-7,10-11H,1-2,8-9,12H2,(H,24,28)(H,25,26);3-6,9-11H,1-2,7-8,12H2,(H,24,28)(H,25,26);1,3-5,8-10,27H,2,6-7,11-12H2,(H,23,28)(H,24,25);4-7,10-12H,1-3,8-9,13H2,(H,22,26)(H,23,24);3-6,9-11H,1-2,7-8,13H2,(H,22,26)(H,23,24);1-5H,6-8H2,(H,20,25)(H,21,22,23).
What are the key properties of 5-cyano-2-(3,3-difluoropiperidin-1-yl)-N-[(3-thiophen-2-yl-1H-pyrazol-5-yl)methyl]benzamide;5-cyano-2-pyrrolidin-1-yl-N-[(3-thiophen-2-yl-1H-pyrazol-5-yl)methyl]benzamide;3-(3,3-difluoroazetidin-1-yl)-N-[(3-thiophen-2-yl-1H-1,2,4-triazol-5-yl)methyl]pyrazine-2-carboxamide;2-(3,3-difluoropiperidin-1-yl)-5-hydroxy-N-[(3-thiophen-2-yl-1H-pyrazol-5-yl)methyl]benzamide;5-fluoro-2-piperidin-1-yl-N-[(3-thiophen-2-yl-1H-pyrazol-5-yl)methyl]benzamide;2-pyrrolidin-1-yl-N-[(3-thiophen-2-yl-1H-pyrazol-5-yl)methyl]-3-(trifluoromethyl)benzamide;2-pyrrolidin-1-yl-N-[(3-thiophen-2-yl-1H-pyrazol-5-yl)methyl]-5-(trifluoromethyl)benzamide?
5-cyano-2-(3,3-difluoropiperidin-1-yl)-N-[(3-thiophen-2-yl-1H-pyrazol-5-yl)methyl]benzamide;5-cyano-2-pyrrolidin-1-yl-N-[(3-thiophen-2-yl-1H-pyrazol-5-yl)methyl]benzamide;3-(3,3-difluoroazetidin-1-yl)-N-[(3-thiophen-2-yl-1H-1,2,4-triazol-5-yl)methyl]pyrazine-2-carboxamide;2-(3,3-difluoropiperidin-1-yl)-5-hydroxy-N-[(3-thiophen-2-yl-1H-pyrazol-5-yl)methyl]benzamide;5-fluoro-2-piperidin-1-yl-N-[(3-thiophen-2-yl-1H-pyrazol-5-yl)methyl]benzamide;2-pyrrolidin-1-yl-N-[(3-thiophen-2-yl-1H-pyrazol-5-yl)methyl]-3-(trifluoromethyl)benzamide;2-pyrrolidin-1-yl-N-[(3-thiophen-2-yl-1H-pyrazol-5-yl)methyl]-5-(trifluoromethyl)benzamide has a molecular weight of 2826.20 g/mol, XLogP of 27.01, 35 rotatable bonds, 15 hydrogen bond donors, and 34 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyano-2-(3,3-difluoropiperidin-1-yl)-N-[(3-thiophen-2-yl-1H-pyrazol-5-yl)methyl]benzamide;5-cyano-2-pyrrolidin-1-yl-N-[(3-thiophen-2-yl-1H-pyrazol-5-yl)methyl]benzamide;3-(3,3-difluoroazetidin-1-yl)-N-[(3-thiophen-2-yl-1H-1,2,4-triazol-5-yl)methyl]pyrazine-2-carboxamide;2-(3,3-difluoropiperidin-1-yl)-5-hydroxy-N-[(3-thiophen-2-yl-1H-pyrazol-5-yl)methyl]benzamide;5-fluoro-2-piperidin-1-yl-N-[(3-thiophen-2-yl-1H-pyrazol-5-yl)methyl]benzamide;2-pyrrolidin-1-yl-N-[(3-thiophen-2-yl-1H-pyrazol-5-yl)methyl]-3-(trifluoromethyl)benzamide;2-pyrrolidin-1-yl-N-[(3-thiophen-2-yl-1H-pyrazol-5-yl)methyl]-5-(trifluoromethyl)benzamide is sourced from PubChem (CID 163918738), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).