N-[3-[bis[(2-methyl-1,3-oxazol-5-yl)methyl]amino]propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;N-[3-[(3,4-dihydroxyphenyl)methyl-[(3-hydroxy-4-methylphenyl)methyl]amino]propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;N-[3-[(2-hydroxyphenyl)methylamino]propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;N-[3-(1H-indol-3-ylmethylamino)propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;N-[3-[(5-methoxy-3-pyridinyl)methylamino]propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;N-[3-[(2-methyl-1,3-oxazol-5-yl)methylamino]propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;N-[3-(pyridin-3-ylmethylamino)propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide

C136H152N34O15S7 — CID 158182069

IUPACN-[3-[bis[(2-methyl-1,3-oxazol-5-yl)methyl]amino]propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;N-[3-[(3,4-dihydroxyphenyl)methyl-[(3-hydroxy-4-methylphenyl)methyl]amino]propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;N-[3-[(2-hydroxyphenyl)methylamino]propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;N-[3-(1H-indol-3-ylmethylamino)propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;N-[3-[(5-methoxy-3-pyridinyl)methylamino]propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;N-[3-[(2-methyl-1,3-oxazol-5-yl)methylamino]propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;N-[3-(pyridin-3-ylmethylamino)propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide
SMILESCOc1cncc(CNCCCNC(=O)c2cc(-c3cccs3)[nH]n2)c1.Cc1ccc(CN(CCCNC(=O)c2cc(-c3cccs3)[nH]n2)Cc2ccc(O)c(O)c2)cc1O.Cc1ncc(CN(CCCNC(=O)c2cc(-c3cccs3)[nH]n2)Cc2cnc(C)o2)o1.Cc1ncc(CNCCCNC(=O)c2cc(-c3cccs3)[nH]n2)o1.O=C(NCCCNCc1c[nH]c2ccccc12)c1cc(-c2cccs2)[nH]n1.O=C(NCCCNCc1ccccc1O)c1cc(-c2cccs2)[nH]n1.O=C(NCCCNCc1cccnc1)c1cc(-c2cccs2)[nH]n1
InChIInChI=1S/C26H28N4O4S.C21H24N6O3S.C20H21N5OS.C18H21N5O2S.C18H20N4O2S.C17H19N5OS.C16H19N5O2S/c1-17-5-6-18(12-23(17)32)15-30(16-19-7-8-22(31)24(33)13-19)10-3-9-27-26(34)21-14-20(28-29-21)25-4-2-11-35-25;1-14-23-10-16(29-14)12-27(13-17-11-24-15(2)30-17)7-4-6-22-21(28)19-9-18(25-26-19)20-5-3-8-31-20;26-20(18-11-17(24-25-18)19-7-3-10-27-19)22-9-4-8-21-12-14-13-23-16-6-2-1-5-15(14)16;1-25-14-8-13(11-20-12-14)10-19-5-3-6-21-18(24)16-9-15(22-23-16)17-4-2-7-26-17;23-16-6-2-1-5-13(16)12-19-8-4-9-20-18(24)15-11-14(21-22-15)17-7-3-10-25-17;23-17(15-10-14(21-22-15)16-5-2-9-24-16)20-8-3-7-19-12-13-4-1-6-18-11-13;1-11-19-10-12(23-11)9-17-5-3-6-18-16(22)14-8-13(20-21-14)15-4-2-7-24-15/h2,4-8,11-14,31-33H,3,9-10,15-16H2,1H3,(H,27,34)(H,28,29);3,5,8-11H,4,6-7,12-13H2,1-2H3,(H,22,28)(H,25,26);1-3,5-7,10-11,13,21,23H,4,8-9,12H2,(H,22,26)(H,24,25);2,4,7-9,11-12,19H,3,5-6,10H2,1H3,(H,21,24)(H,22,23);1-3,5-7,10-11,19,23H,4,8-9,12H2,(H,20,24)(H,21,22);1-2,4-6,9-11,19H,3,7-8,12H2,(H,20,23)(H,21,22);2,4,7-8,10,17H,3,5-6,9H2,1H3,(H,18,22)(H,20,21)
InChIKeyFYSGCJJRYQPCDI-UHFFFAOYSA-N
MW2727.40 g/mol
LogP21.46
Rot. Bonds61

About N-[3-[bis[(2-methyl-1,3-oxazol-5-yl)methyl]amino]propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;N-[3-[(3,4-dihydroxyphenyl)methyl-[(3-hydroxy-4-methylphenyl)methyl]amino]propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;N-[3-[(2-hydroxyphenyl)methylamino]propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;N-[3-(1H-indol-3-ylmethylamino)propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;N-[3-[(5-methoxy-3-pyridinyl)methylamino]propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;N-[3-[(2-methyl-1,3-oxazol-5-yl)methylamino]propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;N-[3-(pyridin-3-ylmethylamino)propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide

N-[3-[bis[(2-methyl-1,3-oxazol-5-yl)methyl]amino]propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;N-[3-[(3,4-dihydroxyphenyl)methyl-[(3-hydroxy-4-methylphenyl)methyl]amino]propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;N-[3-[(2-hydroxyphenyl)methylamino]propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;N-[3-(1H-indol-3-ylmethylamino)propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;N-[3-[(5-methoxy-3-pyridinyl)methylamino]propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;N-[3-[(2-methyl-1,3-oxazol-5-yl)methylamino]propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;N-[3-(pyridin-3-ylmethylamino)propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide (PubChem CID 158182069) has the molecular formula C136H152N34O15S7 and a molecular weight of 2727.40 g/mol. Its IUPAC name is N-[3-[bis[(2-methyl-1,3-oxazol-5-yl)methyl]amino]propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;N-[3-[(3,4-dihydroxyphenyl)methyl-[(3-hydroxy-4-methylphenyl)methyl]amino]propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;N-[3-[(2-hydroxyphenyl)methylamino]propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;N-[3-(1H-indol-3-ylmethylamino)propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;N-[3-[(5-methoxy-3-pyridinyl)methylamino]propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;N-[3-[(2-methyl-1,3-oxazol-5-yl)methylamino]propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;N-[3-(pyridin-3-ylmethylamino)propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide.

Molecular Properties

Compound NameN-[3-[bis[(2-methyl-1,3-oxazol-5-yl)methyl]amino]propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;N-[3-[(3,4-dihydroxyphenyl)methyl-[(3-hydroxy-4-methylphenyl)methyl]amino]propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;N-[3-[(2-hydroxyphenyl)methylamino]propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;N-[3-(1H-indol-3-ylmethylamino)propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;N-[3-[(5-methoxy-3-pyridinyl)methylamino]propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;N-[3-[(2-methyl-1,3-oxazol-5-yl)methylamino]propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;N-[3-(pyridin-3-ylmethylamino)propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide
PubChem CID158182069
Molecular FormulaC136H152N34O15S7
Molecular Weight2727.40 g/mol
Exact Mass2725.02
IUPAC NameN-[3-[bis[(2-methyl-1,3-oxazol-5-yl)methyl]amino]propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;N-[3-[(3,4-dihydroxyphenyl)methyl-[(3-hydroxy-4-methylphenyl)methyl]amino]propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;N-[3-[(2-hydroxyphenyl)methylamino]propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;N-[3-(1H-indol-3-ylmethylamino)propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;N-[3-[(5-methoxy-3-pyridinyl)methylamino]propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;N-[3-[(2-methyl-1,3-oxazol-5-yl)methylamino]propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;N-[3-(pyridin-3-ylmethylamino)propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide
SMILESCOc1cncc(CNCCCNC(=O)c2cc(-c3cccs3)[nH]n2)c1.Cc1ccc(CN(CCCNC(=O)c2cc(-c3cccs3)[nH]n2)Cc2ccc(O)c(O)c2)cc1O.Cc1ncc(CN(CCCNC(=O)c2cc(-c3cccs3)[nH]n2)Cc2cnc(C)o2)o1.Cc1ncc(CNCCCNC(=O)c2cc(-c3cccs3)[nH]n2)o1.O=C(NCCCNCc1c[nH]c2ccccc12)c1cc(-c2cccs2)[nH]n1.O=C(NCCCNCc1ccccc1O)c1cc(-c2cccs2)[nH]n1.O=C(NCCCNCc1cccnc1)c1cc(-c2cccs2)[nH]n1
InChIInChI=1S/C26H28N4O4S.C21H24N6O3S.C20H21N5OS.C18H21N5O2S.C18H20N4O2S.C17H19N5OS.C16H19N5O2S/c1-17-5-6-18(12-23(17)32)15-30(16-19-7-8-22(31)24(33)13-19)10-3-9-27-26(34)21-14-20(28-29-21)25-4-2-11-35-25;1-14-23-10-16(29-14)12-27(13-17-11-24-15(2)30-17)7-4-6-22-21(28)19-9-18(25-26-19)20-5-3-8-31-20;26-20(18-11-17(24-25-18)19-7-3-10-27-19)22-9-4-8-21-12-14-13-23-16-6-2-1-5-15(14)16;1-25-14-8-13(11-20-12-14)10-19-5-3-6-21-18(24)16-9-15(22-23-16)17-4-2-7-26-17;23-16-6-2-1-5-13(16)12-19-8-4-9-20-18(24)15-11-14(21-22-15)17-7-3-10-25-17;23-17(15-10-14(21-22-15)16-5-2-9-24-16)20-8-3-7-19-12-13-4-1-6-18-11-13;1-11-19-10-12(23-11)9-17-5-3-6-18-16(22)14-8-13(20-21-14)15-4-2-7-24-15/h2,4-8,11-14,31-33H,3,9-10,15-16H2,1H3,(H,27,34)(H,28,29);3,5,8-11H,4,6-7,12-13H2,1-2H3,(H,22,28)(H,25,26);1-3,5-7,10-11,13,21,23H,4,8-9,12H2,(H,22,26)(H,24,25);2,4,7-9,11-12,19H,3,5-6,10H2,1H3,(H,21,24)(H,22,23);1-3,5-7,10-11,19,23H,4,8-9,12H2,(H,20,24)(H,21,22);1-2,4-6,9-11,19H,3,7-8,12H2,(H,20,23)(H,21,22);2,4,7-8,10,17H,3,5-6,9H2,1H3,(H,18,22)(H,20,21)
InChIKeyFYSGCJJRYQPCDI-UHFFFAOYSA-N
XLogP21.46
TPSA680.90 Ų
H-Bond Donors24
H-Bond Acceptors41
Rotatable Bonds61
Heavy Atoms192
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002727.40
LogP ≤ 521.46
H-Bond Donors ≤ 524
H-Bond Acceptors ≤ 1041

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'mannich_A(296)', 'substructure': 'N/A'}, {'alert_name': 'catechol_A(92)', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'catechol', 'substructure': 'N/A'}

Analyze N-[3-[bis[(2-methyl-1,3-oxazol-5-yl)methyl]amino]propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;N-[3-[(3,4-dihydroxyphenyl)methyl-[(3-hydroxy-4-methylphenyl)methyl]amino]propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;N-[3-[(2-hydroxyphenyl)methylamino]propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;N-[3-(1H-indol-3-ylmethylamino)propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;N-[3-[(5-methoxy-3-pyridinyl)methylamino]propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;N-[3-[(2-methyl-1,3-oxazol-5-yl)methylamino]propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;N-[3-(pyridin-3-ylmethylamino)propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide with MolForge

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Related Compounds

(2S)-N-[3-(5-acetylthiophen-2-yl)-1H-indazol-5-yl]-1-benzylpyrrolidine-2-carboxamide;(2S)-N-[3-(1-benzofuran-2-yl)-1H-indazol-5-yl]pyrrolidine-2-carboxamide;N-[3-(1-benzothiophen-2-yl)-1H-indazol-5-yl]-1-benzylpiperidine-4-carboxamide;(2S)-N-[3-(3-ethoxyphenyl)-1H-indazol-5-yl]-1-[[3-(trifluoromethyl)phenyl]methyl]pyrrolidine-2-carboxamide;(3R)-3-hydroxy-3-phenyl-N-(3-pyridin-3-yl-1H-indazol-5-yl)propanamide;N-(3-naphthalen-2-yl-1H-indazol-5-yl)piperidine-4-carboxamide
CID 159622710
2-chloro-2'-(1H-indazol-7-yl)-6'-methylspiro[4,5-dihydrothieno[2,3-c]pyran-7,4'-piperidine];2-chloro-2'-(2H-indazol-3-yl)-6'-methylspiro[4,5-dihydrothieno[2,3-c]pyran-7,4'-piperidine];2-chloro-2'-methyl-6'-(2-methyl-1,3-benzoxazol-4-yl)spiro[4,5-dihydrothieno[2,3-c]pyran-7,4'-piperidine];2-chloro-2'-methyl-6'-(3-methyl-2-pyridinyl)spiro[4,5-dihydrothieno[2,3-c]pyran-7,4'-piperidine];2-(2-chloro-6'-methylspiro[4,5-dihydrothieno[2,3-c]pyran-7,4'-piperidine]-2'-yl)-6-methoxyphenol;2-chloro-2'-methyl-6'-[4-(trifluoromethyl)-3H-pyrrol-2-yl]spiro[4,5-dihydrothieno[2,3-c]pyran-7,4'-piperidine]
CID 164976546
CID 157139324
CID 157139324
[2-[[3-(hydroxymethyl)phenyl]methoxy]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]-(4-methylphenyl)methanone;[2-[[4-(hydroxymethyl)phenyl]methoxy]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]-(4-methylphenyl)methanone;1H-indol-3-yl-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;[2-[(2-methoxyphenyl)methoxy]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]-(4-methylphenyl)methanone;(4-methylphenyl)-[2-(pyridin-2-ylmethoxy)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]methanone;(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)-pyridin-2-ylmethanone;(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)-(3H-pyrrol-4-yl)methanone;(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)-thiophen-3-ylmethanone;phenyl-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone
CID 157819693
CID 157944944
CID 157944944
tert-butyl 3-propan-2-ylpyrrolidine-1-carboxylate;4-methyl-2-phenyl-5-propan-2-yl-1,3-oxazole;5-methyl-1-phenyl-4-propan-2-ylpyrazole;3-methyl-1-(4-propan-2-ylphenyl)pyrazole;5-propan-2-yl-1,3-benzodioxole;3-propan-2-ylcyclopentene;2-propan-2-ylfuran;3-propan-2-yl-1H-indole;4-(4-propan-2-ylphenyl)thiadiazole;4-propan-2-ylpyridine;3-propan-2-yl-1H-pyrrole;3-propan-2-ylthiophene;5-propan-2-yl-4H-triazole
CID 158111056
N-[4-(2,3-dihydro-1,4-benzodioxin-5-yl)-3-oxo-1-phenylbutan-2-yl]-1H-indole-4-carboxamide;N-[1-(4-hydroxyphenyl)-4-(1H-indol-7-yl)-3-oxobutan-2-yl]benzamide;N-[4-(1H-indazol-7-yl)-3-oxo-1-phenylbutan-2-yl]benzamide;N-[4-(1H-indol-7-yl)-3-oxo-1-phenylbutan-2-yl]thiophene-2-carboxamide;N-(4-isoquinolin-5-yl-3-oxo-1-phenylbutan-2-yl)-1H-indole-4-carboxamide;N-[4-(2-methoxyphenyl)-3-oxo-1-phenylbutan-2-yl]-1H-indole-4-carboxamide
CID 158140159
N-[3-[bis[(2-methyl-1,3-oxazol-5-yl)methyl]amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-[3-[(3,4-dihydroxyphenyl)methyl-[(3-hydroxy-4-methylphenyl)methyl]amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-[3-[(2-hydroxyphenyl)methylamino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-[3-(1H-indol-3-ylmethylamino)propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-[3-[(3-methoxyphenyl)methyl-[(5-methoxy-3-pyridinyl)methyl]amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-[3-[(5-methoxy-3-pyridinyl)methylamino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-[3-[(2-methyl-1,3-oxazol-5-yl)methylamino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide
CID 158193723
N-cyclopropyl-3-[(E)-2-(2,3-dihydro-1-benzofuran-5-yl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;3-[(E)-2-(2,3-dihydro-1-benzofuran-5-yl)ethenyl]-4-methoxy-N-(1,3-oxazol-2-ylmethyl)-2H-indazole-5-carboxamide;3-[(E)-2-(2,3-dihydro-1-benzofuran-5-yl)ethenyl]-4-methoxy-N-(pyridin-3-ylmethyl)-2H-indazole-5-carboxamide;3-[(E)-2-(2,3-dihydro-1-benzofuran-5-yl)ethenyl]-4-methoxy-N-(thiophen-2-ylmethyl)-2H-indazole-5-carboxamide
CID 159244559
N-[3-[(1-acetylindol-3-yl)methylamino]propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;N-[3-[(2-hydroxy-4-methylphenyl)methylamino]propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;N-[3-[(3-methoxyphenyl)methyl-[(5-methoxy-3-pyridinyl)methyl]amino]propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;N-[3-[(4-methylfuran-2-yl)methyl-[(3-methyl-1,2-oxazol-5-yl)methyl]amino]propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;N-[3-[(3-methyl-1,2-oxazol-5-yl)methylamino]propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;N-[3-(1H-pyrrolo[2,3-b]pyridin-3-ylmethylamino)propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;N-[3-(2H-pyrrol-4-ylmethylamino)propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide
CID 159512223
N-[4-(2,3-dihydro-1,4-benzodioxin-5-yl)-1-(4-hydroxyphenyl)-3-oxobutan-2-yl]thiophene-2-carboxamide;N-[1-(4-hydroxyphenyl)-4-(1H-indol-7-yl)-3-oxobutan-2-yl]benzamide;N-[4-(1H-indazol-4-yl)-3-oxo-1-phenylbutan-2-yl]benzamide;N-[4-(1H-indazol-7-yl)-3-oxo-1-phenylbutan-2-yl]benzamide;N-[4-(1H-indol-7-yl)-3-oxo-1-phenylbutan-2-yl]thiophene-2-carboxamide;N-[4-(2-methoxy-3-pyridinyl)-3-oxo-1-phenylbutan-2-yl]benzamide;N-(3-oxo-1-phenyl-4-phthalazin-5-ylbutan-2-yl)benzamide
CID 159629140
N-[3-[bis[(2-methyl-1,3-oxazol-5-yl)methyl]amino]propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;N-[3-[(3,4-dihydroxyphenyl)methyl-[(3-hydroxy-4-methylphenyl)methyl]amino]propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;methane;N-[3-[(3-methoxyphenyl)methyl-[(5-methoxy-3-pyridinyl)methyl]amino]propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;N-[3-[(4-methylfuran-2-yl)methyl-[(3-methyl-1,2-oxazol-5-yl)methyl]amino]propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;N-[3-[1,2-oxazol-4-ylmethyl(2H-pyrrol-4-ylmethyl)amino]propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide
CID 159663787

Frequently Asked Questions

What is the IUPAC name of N-[3-[bis[(2-methyl-1,3-oxazol-5-yl)methyl]amino]propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;N-[3-[(3,4-dihydroxyphenyl)methyl-[(3-hydroxy-4-methylphenyl)methyl]amino]propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;N-[3-[(2-hydroxyphenyl)methylamino]propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;N-[3-(1H-indol-3-ylmethylamino)propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;N-[3-[(5-methoxy-3-pyridinyl)methylamino]propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;N-[3-[(2-methyl-1,3-oxazol-5-yl)methylamino]propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;N-[3-(pyridin-3-ylmethylamino)propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide?
The IUPAC name of N-[3-[bis[(2-methyl-1,3-oxazol-5-yl)methyl]amino]propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;N-[3-[(3,4-dihydroxyphenyl)methyl-[(3-hydroxy-4-methylphenyl)methyl]amino]propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;N-[3-[(2-hydroxyphenyl)methylamino]propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;N-[3-(1H-indol-3-ylmethylamino)propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;N-[3-[(5-methoxy-3-pyridinyl)methylamino]propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;N-[3-[(2-methyl-1,3-oxazol-5-yl)methylamino]propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;N-[3-(pyridin-3-ylmethylamino)propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide (CID 158182069) is N-[3-[bis[(2-methyl-1,3-oxazol-5-yl)methyl]amino]propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;N-[3-[(3,4-dihydroxyphenyl)methyl-[(3-hydroxy-4-methylphenyl)methyl]amino]propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;N-[3-[(2-hydroxyphenyl)methylamino]propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;N-[3-(1H-indol-3-ylmethylamino)propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;N-[3-[(5-methoxy-3-pyridinyl)methylamino]propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;N-[3-[(2-methyl-1,3-oxazol-5-yl)methylamino]propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;N-[3-(pyridin-3-ylmethylamino)propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide.
What is the SMILES notation for N-[3-[bis[(2-methyl-1,3-oxazol-5-yl)methyl]amino]propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;N-[3-[(3,4-dihydroxyphenyl)methyl-[(3-hydroxy-4-methylphenyl)methyl]amino]propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;N-[3-[(2-hydroxyphenyl)methylamino]propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;N-[3-(1H-indol-3-ylmethylamino)propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;N-[3-[(5-methoxy-3-pyridinyl)methylamino]propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;N-[3-[(2-methyl-1,3-oxazol-5-yl)methylamino]propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;N-[3-(pyridin-3-ylmethylamino)propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide?
The canonical SMILES for N-[3-[bis[(2-methyl-1,3-oxazol-5-yl)methyl]amino]propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;N-[3-[(3,4-dihydroxyphenyl)methyl-[(3-hydroxy-4-methylphenyl)methyl]amino]propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;N-[3-[(2-hydroxyphenyl)methylamino]propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;N-[3-(1H-indol-3-ylmethylamino)propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;N-[3-[(5-methoxy-3-pyridinyl)methylamino]propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;N-[3-[(2-methyl-1,3-oxazol-5-yl)methylamino]propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;N-[3-(pyridin-3-ylmethylamino)propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide is COc1cncc(CNCCCNC(=O)c2cc(-c3cccs3)[nH]n2)c1.Cc1ccc(CN(CCCNC(=O)c2cc(-c3cccs3)[nH]n2)Cc2ccc(O)c(O)c2)cc1O.Cc1ncc(CN(CCCNC(=O)c2cc(-c3cccs3)[nH]n2)Cc2cnc(C)o2)o1.Cc1ncc(CNCCCNC(=O)c2cc(-c3cccs3)[nH]n2)o1.O=C(NCCCNCc1c[nH]c2ccccc12)c1cc(-c2cccs2)[nH]n1.O=C(NCCCNCc1ccccc1O)c1cc(-c2cccs2)[nH]n1.O=C(NCCCNCc1cccnc1)c1cc(-c2cccs2)[nH]n1.
What is the InChIKey of N-[3-[bis[(2-methyl-1,3-oxazol-5-yl)methyl]amino]propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;N-[3-[(3,4-dihydroxyphenyl)methyl-[(3-hydroxy-4-methylphenyl)methyl]amino]propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;N-[3-[(2-hydroxyphenyl)methylamino]propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;N-[3-(1H-indol-3-ylmethylamino)propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;N-[3-[(5-methoxy-3-pyridinyl)methylamino]propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;N-[3-[(2-methyl-1,3-oxazol-5-yl)methylamino]propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;N-[3-(pyridin-3-ylmethylamino)propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide?
The InChIKey is FYSGCJJRYQPCDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H28N4O4S.C21H24N6O3S.C20H21N5OS.C18H21N5O2S.C18H20N4O2S.C17H19N5OS.C16H19N5O2S/c1-17-5-6-18(12-23(17)32)15-30(16-19-7-8-22(31)24(33)13-19)10-3-9-27-26(34)21-14-20(28-29-21)25-4-2-11-35-25;1-14-23-10-16(29-14)12-27(13-17-11-24-15(2)30-17)7-4-6-22-21(28)19-9-18(25-26-19)20-5-3-8-31-20;26-20(18-11-17(24-25-18)19-7-3-10-27-19)22-9-4-8-21-12-14-13-23-16-6-2-1-5-15(14)16;1-25-14-8-13(11-20-12-14)10-19-5-3-6-21-18(24)16-9-15(22-23-16)17-4-2-7-26-17;23-16-6-2-1-5-13(16)12-19-8-4-9-20-18(24)15-11-14(21-22-15)17-7-3-10-25-17;23-17(15-10-14(21-22-15)16-5-2-9-24-16)20-8-3-7-19-12-13-4-1-6-18-11-13;1-11-19-10-12(23-11)9-17-5-3-6-18-16(22)14-8-13(20-21-14)15-4-2-7-24-15/h2,4-8,11-14,31-33H,3,9-10,15-16H2,1H3,(H,27,34)(H,28,29);3,5,8-11H,4,6-7,12-13H2,1-2H3,(H,22,28)(H,25,26);1-3,5-7,10-11,13,21,23H,4,8-9,12H2,(H,22,26)(H,24,25);2,4,7-9,11-12,19H,3,5-6,10H2,1H3,(H,21,24)(H,22,23);1-3,5-7,10-11,19,23H,4,8-9,12H2,(H,20,24)(H,21,22);1-2,4-6,9-11,19H,3,7-8,12H2,(H,20,23)(H,21,22);2,4,7-8,10,17H,3,5-6,9H2,1H3,(H,18,22)(H,20,21).
What are the key properties of N-[3-[bis[(2-methyl-1,3-oxazol-5-yl)methyl]amino]propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;N-[3-[(3,4-dihydroxyphenyl)methyl-[(3-hydroxy-4-methylphenyl)methyl]amino]propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;N-[3-[(2-hydroxyphenyl)methylamino]propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;N-[3-(1H-indol-3-ylmethylamino)propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;N-[3-[(5-methoxy-3-pyridinyl)methylamino]propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;N-[3-[(2-methyl-1,3-oxazol-5-yl)methylamino]propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;N-[3-(pyridin-3-ylmethylamino)propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide?
N-[3-[bis[(2-methyl-1,3-oxazol-5-yl)methyl]amino]propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;N-[3-[(3,4-dihydroxyphenyl)methyl-[(3-hydroxy-4-methylphenyl)methyl]amino]propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;N-[3-[(2-hydroxyphenyl)methylamino]propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;N-[3-(1H-indol-3-ylmethylamino)propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;N-[3-[(5-methoxy-3-pyridinyl)methylamino]propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;N-[3-[(2-methyl-1,3-oxazol-5-yl)methylamino]propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;N-[3-(pyridin-3-ylmethylamino)propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide has a molecular weight of 2727.40 g/mol, XLogP of 21.46, 61 rotatable bonds, 24 hydrogen bond donors, and 41 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[bis[(2-methyl-1,3-oxazol-5-yl)methyl]amino]propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;N-[3-[(3,4-dihydroxyphenyl)methyl-[(3-hydroxy-4-methylphenyl)methyl]amino]propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;N-[3-[(2-hydroxyphenyl)methylamino]propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;N-[3-(1H-indol-3-ylmethylamino)propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;N-[3-[(5-methoxy-3-pyridinyl)methylamino]propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;N-[3-[(2-methyl-1,3-oxazol-5-yl)methylamino]propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;N-[3-(pyridin-3-ylmethylamino)propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide is sourced from PubChem (CID 158182069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).