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

C140H157N35O14S7 — CID 159512223

IUPACN-[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
SMILESCC(=O)n1cc(CNCCCNC(=O)c2cc(-c3cccs3)[nH]n2)c2ccccc21.COc1cccc(CN(CCCNC(=O)c2cc(-c3cccs3)[nH]n2)Cc2cncc(OC)c2)c1.Cc1cc(CNCCCNC(=O)c2cc(-c3cccs3)[nH]n2)on1.Cc1ccc(CNCCCNC(=O)c2cc(-c3cccs3)[nH]n2)c(O)c1.Cc1coc(CN(CCCNC(=O)c2cc(-c3cccs3)[nH]n2)Cc2cc(C)no2)c1.O=C(NCCCNCC1=CCN=C1)c1cc(-c2cccs2)[nH]n1.O=C(NCCCNCc1c[nH]c2ncccc12)c1cc(-c2cccs2)[nH]n1
InChIInChI=1S/C26H29N5O3S.C22H25N5O3S.C22H23N5O2S.C19H20N6OS.C19H22N4O2S.C16H19N5O2S.C16H19N5OS/c1-33-21-7-3-6-19(12-21)17-31(18-20-13-22(34-2)16-27-15-20)10-5-9-28-26(32)24-14-23(29-30-24)25-8-4-11-35-25;1-15-9-17(29-14-15)12-27(13-18-10-16(2)26-30-18)7-4-6-23-22(28)20-11-19(24-25-20)21-5-3-8-31-21;1-15(28)27-14-16(17-6-2-3-7-20(17)27)13-23-9-5-10-24-22(29)19-12-18(25-26-19)21-8-4-11-30-21;26-19(16-10-15(24-25-16)17-5-2-9-27-17)22-8-3-6-20-11-13-12-23-18-14(13)4-1-7-21-18;1-13-5-6-14(17(24)10-13)12-20-7-3-8-21-19(25)16-11-15(22-23-16)18-4-2-9-26-18;1-11-8-12(23-21-11)10-17-5-3-6-18-16(22)14-9-13(19-20-14)15-4-2-7-24-15;22-16(14-9-13(20-21-14)15-3-1-8-23-15)19-6-2-5-17-10-12-4-7-18-11-12/h3-4,6-8,11-16H,5,9-10,17-18H2,1-2H3,(H,28,32)(H,29,30);3,5,8-11,14H,4,6-7,12-13H2,1-2H3,(H,23,28)(H,24,25);2-4,6-8,11-12,14,23H,5,9-10,13H2,1H3,(H,24,29)(H,25,26);1-2,4-5,7,9-10,12,20H,3,6,8,11H2,(H,21,23)(H,22,26)(H,24,25);2,4-6,9-11,20,24H,3,7-8,12H2,1H3,(H,21,25)(H,22,23);2,4,7-9,17H,3,5-6,10H2,1H3,(H,18,22)(H,19,20);1,3-4,8-9,11,17H,2,5-7,10H2,(H,19,22)(H,20,21)
InChIKeyMATBACNSUTUUES-UHFFFAOYSA-N
MW2778.50 g/mol
LogP22.38
Rot. Bonds62

About 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

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 (PubChem CID 159512223) has the molecular formula C140H157N35O14S7 and a molecular weight of 2778.50 g/mol. Its IUPAC name is 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.

Molecular Properties

Compound NameN-[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
PubChem CID159512223
Molecular FormulaC140H157N35O14S7
Molecular Weight2778.50 g/mol
Exact Mass2776.07
IUPAC NameN-[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
SMILESCC(=O)n1cc(CNCCCNC(=O)c2cc(-c3cccs3)[nH]n2)c2ccccc21.COc1cccc(CN(CCCNC(=O)c2cc(-c3cccs3)[nH]n2)Cc2cncc(OC)c2)c1.Cc1cc(CNCCCNC(=O)c2cc(-c3cccs3)[nH]n2)on1.Cc1ccc(CNCCCNC(=O)c2cc(-c3cccs3)[nH]n2)c(O)c1.Cc1coc(CN(CCCNC(=O)c2cc(-c3cccs3)[nH]n2)Cc2cc(C)no2)c1.O=C(NCCCNCC1=CCN=C1)c1cc(-c2cccs2)[nH]n1.O=C(NCCCNCc1c[nH]c2ncccc12)c1cc(-c2cccs2)[nH]n1
InChIInChI=1S/C26H29N5O3S.C22H25N5O3S.C22H23N5O2S.C19H20N6OS.C19H22N4O2S.C16H19N5O2S.C16H19N5OS/c1-33-21-7-3-6-19(12-21)17-31(18-20-13-22(34-2)16-27-15-20)10-5-9-28-26(32)24-14-23(29-30-24)25-8-4-11-35-25;1-15-9-17(29-14-15)12-27(13-18-10-16(2)26-30-18)7-4-6-23-22(28)20-11-19(24-25-20)21-5-3-8-31-21;1-15(28)27-14-16(17-6-2-3-7-20(17)27)13-23-9-5-10-24-22(29)19-12-18(25-26-19)21-8-4-11-30-21;26-19(16-10-15(24-25-16)17-5-2-9-27-17)22-8-3-6-20-11-13-12-23-18-14(13)4-1-7-21-18;1-13-5-6-14(17(24)10-13)12-20-7-3-8-21-19(25)16-11-15(22-23-16)18-4-2-9-26-18;1-11-8-12(23-21-11)10-17-5-3-6-18-16(22)14-9-13(19-20-14)15-4-2-7-24-15;22-16(14-9-13(20-21-14)15-3-1-8-23-15)19-6-2-5-17-10-12-4-7-18-11-12/h3-4,6-8,11-16H,5,9-10,17-18H2,1-2H3,(H,28,32)(H,29,30);3,5,8-11,14H,4,6-7,12-13H2,1-2H3,(H,23,28)(H,24,25);2-4,6-8,11-12,14,23H,5,9-10,13H2,1H3,(H,24,29)(H,25,26);1-2,4-5,7,9-10,12,20H,3,6,8,11H2,(H,21,23)(H,22,26)(H,24,25);2,4-6,9-11,20,24H,3,7-8,12H2,1H3,(H,21,25)(H,22,23);2,4,7-9,17H,3,5-6,10H2,1H3,(H,18,22)(H,19,20);1,3-4,8-9,11,17H,2,5-7,10H2,(H,19,22)(H,20,21)
InChIKeyMATBACNSUTUUES-UHFFFAOYSA-N
XLogP22.38
TPSA650.91 Ų
H-Bond Donors21
H-Bond Acceptors41
Rotatable Bonds62
Heavy Atoms196
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002778.50
LogP ≤ 522.38
H-Bond Donors ≤ 521
H-Bond Acceptors ≤ 1041

Computed Properties (RDKit)

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

Analyze 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 with MolForge

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

Launch Full Analysis

Related Compounds

CID 159320113
CID 159320113
cumene;methane;2-methyl-5-propan-2-yl-1,3-thiazole;4-methyl-2-propan-2-yl-1,3-thiazole;2-propan-2-ylfuran;2-propan-2-yl-1H-imidazole;2-propan-2-yl-1H-indole;5-propan-2-yl-1,2,4-oxadiazole;bis(2-propan-2-yl-1,3-oxazole);5-propan-2-yl-1,2-oxazole;2-propan-2-ylpyrazine;bis(5-propan-2-yl-1H-pyrazole);bis(2-propan-2-ylpyridine);3-propan-2-ylpyridine;2-propan-2-ylpyrimidine;2-propan-2-yl-1H-pyrrole;5-propan-2-yl-1,2,4-thiadiazole;bis(2-propan-2-yl-1,3-thiazole);bis(2-propan-2-ylthiophene);2-propan-2-yl-5-(trifluoromethyl)-1,3-thiazole
CID 159939351
3-butyl-4-propan-2-yl-2H-1,2,3,5-oxatriazole;1-cyclopentyl-4-propan-2-ylpyrazole;1-(2,2-difluoroethyl)-3-propan-2-ylpyrazole;1-(2,2-difluoropropyl)-5-propan-2-ylpyrazole;3,4-dimethyl-5-propan-2-yl-1,2-oxazole;N,1-dimethyl-3-propan-2-ylpyrazole-5-carboxamide;1,6-dimethyl-4-propan-2-ylpyrazolo[3,4-b]pyridine;1-ethyl-3-methyl-5-propan-2-ylpyrazole;1-ethyl-5-methyl-3-propan-2-ylpyrazole;2-ethyl-5-propan-2-ylthiophene;1-(1-fluoroethyl)-3-methyl-5-propan-2-ylpyrazole;3-(furan-2-yl)-5-propan-2-yl-1H-pyrazole;4-methoxy-1-methyl-2-propan-2-ylbenzene;4-methyl-1,5-di(propan-2-yl)pyrazole;4-methyl-3-propan-2-yl-1-propylpyrazole;N-(1-methyl-5-propan-2-ylpyrazol-3-yl)acetamide;3-methyl-4-propan-2-ylpyridine;2-methyl-3-propan-2-yl-4,5,6,7-tetrahydroindazole;5-propan-2-yl-1-propylpyrazole;2-propan-2-yl-4,5,6,7-tetrahydro-1-benzothiophene;5-propan-2-yl-1,3-thiazole;3-propan-2-ylthiophene
CID 162278390
1-cyclopentyl-4-propan-2-ylpyrazole;1-(2,2-difluoroethyl)-3-propan-2-ylpyrazole;1-(2,2-difluoropropyl)-5-propan-2-ylpyrazole;3,4-dimethyl-5-propan-2-yl-1,2-oxazole;N,1-dimethyl-3-propan-2-ylpyrazole-5-carboxamide;1,6-dimethyl-4-propan-2-ylpyrazolo[3,4-b]pyridine;2-ethyl-5-propan-2-ylthiophene;1-(1-fluoroethyl)-3-methyl-5-propan-2-ylpyrazole;3-(furan-2-yl)-5-propan-2-yl-1H-pyrazole;4-methyl-1,5-di(propan-2-yl)pyrazole;4-methyl-3-propan-2-yl-1-propylpyrazole;N-(1-methyl-5-propan-2-ylpyrazol-3-yl)acetamide;5-propan-2-yl-1-propylpyrazole;2-propan-2-yl-4,5,6,7-tetrahydro-1-benzothiophene;3-propan-2-ylthiophene
CID 162278396
1-chloro-5-propan-2-yl-3-propylpyrazole;1-cyclopentyl-4-propan-2-ylpyrazole;1-(2,2-difluoroethyl)-3-propan-2-ylpyrazole;1-(2,2-difluoropropyl)-5-propan-2-ylpyrazole;2,3-dimethyl-5-propan-2-yl-1H-indole;3,4-dimethyl-5-propan-2-yl-1,2-oxazole;N,1-dimethyl-3-propan-2-ylpyrazole-5-carboxamide;1,6-dimethyl-4-propan-2-ylpyrazolo[3,4-b]pyridine;1-ethyl-3-methyl-5-propan-2-ylpyrazole;1-ethyl-5-methyl-3-propan-2-ylpyrazole;2-ethyl-5-propan-2-ylthiophene;1-(1-fluoroethyl)-3-methyl-5-propan-2-ylpyrazole;2-(furan-2-yl)-4-propan-2-yl-1H-pyrrole;4-methoxy-1-methyl-2-propan-2-ylbenzene;4-methyl-1,5-di(propan-2-yl)pyrazole;3-methyl-5-propan-2-yl-1,2-oxazole;N-(1-methyl-5-propan-2-ylpyrazol-3-yl)acetamide;3-methyl-4-propan-2-ylpyridine;3-(4-propan-2-yl-1,2,5-oxadiazol-3-yl)propan-1-ol;5-propan-2-yl-1-propylpyrazole;2-propan-2-yl-4,5,6,7-tetrahydro-1-benzothiophene;3-propan-2-ylthiophene
CID 162278397
2-[2-[2-[2-[3-[2-[3-[2-[3-[2-[5-(9H-carbazol-1-yl)-6-dibenzofuran-1-yl-7-pyridin-2-yl-3H-benzimidazol-4-yl]-1-benzofuran-3-yl]-2H-isoindol-1-yl]quinazolin-4-yl]quinoxalin-2-yl]pyrimidin-4-yl]-1H-indazol-4-yl]furan-3-yl]thiophen-3-yl]-1H-pyrrol-3-yl]-1,3-oxazole
CID 91005795
2-[7-(furan-2-yl)-1-(1H-indol-2-yl)-3-(1,2-oxazol-3-yl)-5-pyrazin-2-yl-3-pyridazin-3-yl-6-pyridin-2-yl-4-pyrimidin-2-yl-1-thiophen-2-ylisoindol-2-yl]-1,3-oxazole
CID 141049907
2-[4-(furan-2-yl)-2-(1H-imidazol-2-yl)-5-(1H-indol-2-yl)-2-(4-naphthalen-1-yl-5-phenyl-1H-pyrazol-3-yl)-6-(1,2-oxazol-3-yl)-3-phenylsulfanyl-6-(1H-pyrrol-2-yl)-3-(1H-tetrazol-5-yl)-5-(1,3-thiazol-2-yl)-4-(1H-triazol-4-yl)piperidin-1-yl]-1,3-oxazole
CID 141454607
2-[2-[4-acridin-1-yl-5-(9H-carbazol-1-yl)-6-cinnolin-3-ylpyrimidin-2-yl]-8a-(1H-benzimidazol-2-yl)-1-[3-(1-benzofuran-2-yl)-4-(1-benzothiophen-2-yl)-2-(1H-benzotriazol-4-yl)-1-(furan-2-yl)-3-(1H-indol-2-yl)-4-(1H-pyrazol-3-yl)-5-quinoxalin-2-yl-5-thiophen-2-ylpyrrolidin-2-yl]-5-(2,3-dihydro-1H-isoindol-1-yl)-4a-(1H-imidazo[4,5-b]pyridin-2-yl)-7-(1H-indazol-3-yl)-4-(1H-indol-2-yl)-8-(2H-isoindol-1-yl)-6-isoquinolin-1-yl-5-(oxadiazol-4-yl)-4-(1,2-oxazol-3-yl)-6-(1,3-oxazol-2-yl)-3-pyrazin-2-yl-3-pyridazin-3-yl-2-pyridin-2-yl-7-quinolin-2-ylquinolin-8-yl]-1,3-benzoxazole
CID 141734411
5-[7-[4-[2-[7-[4-[2-(5-piperidin-4-yl-1H-pyrazolo[3,4-c]pyridin-3-yl)-1H-benzimidazol-4-yl]furan-2-yl]-5-pyridin-4-yl-1H-pyrazolo[3,4-c]pyridin-3-yl]-1H-benzimidazol-4-yl]thiophen-2-yl]-3-(4-thiophen-3-yl-1H-benzimidazol-2-yl)-1H-pyrazolo[3,4-c]pyridin-5-yl]pyridin-3-ol
CID 145033329
3-tert-butylimidazo[1,2-a]pyridine;ethane;methane;4-propan-2-yl-1H-benzimidazole;6-propan-2-yl-1H-benzimidazole;7-propan-2-yl-1-benzofuran;3-propan-2-yl-1-benzothiophene;3-propan-2-yl-1,2-benzoxazole;7-propan-2-yl-1,3-benzoxazole;5-propan-2-yl-1H-indazole;3-propan-2-yl-1H-indole;7-propan-2-yl-1H-indole;3-propan-2-yl-4,5,6,7-tetrahydro-1H-indazole
CID 157085230
tert-butylbenzene;2-tert-butyl-1,3-benzothiazole;2-tert-butyl-1,3-benzoxazole;2-tert-butyl-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazine;2-tert-butylfuran;2-tert-butylimidazo[1,2-a]pyridine;2-tert-butylimidazo[1,2-b]pyridazine;2-tert-butyl-1H-imidazole;5-tert-butyl-1H-imidazole;4-tert-butyloxane;3-tert-butyl-1,2-oxazole;4-tert-butyl-1,2-oxazole;5-tert-butyl-1,2-oxazole;3-tert-butyloxolane;2-tert-butylpyrazine;5-tert-butyl-1H-pyrazole;2-tert-butylpyrazolo[1,5-a]pyridine;3-tert-butylpyridazine;2-tert-butylpyridine;3-tert-butylpyridine;4-tert-butylpyridine;5-tert-butylpyrimidine;4-tert-butyl-1,3-thiazole;2-tert-butylthiophene;3-tert-butylthiophene;4-methyl-1H-pyrazole;2-methylpyrazolo[1,5-a]pyridine
CID 157085631

Frequently Asked Questions

What is the IUPAC name of 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?
The IUPAC name of 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) is 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.
What is the SMILES notation for 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?
The canonical SMILES for 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 is CC(=O)n1cc(CNCCCNC(=O)c2cc(-c3cccs3)[nH]n2)c2ccccc21.COc1cccc(CN(CCCNC(=O)c2cc(-c3cccs3)[nH]n2)Cc2cncc(OC)c2)c1.Cc1cc(CNCCCNC(=O)c2cc(-c3cccs3)[nH]n2)on1.Cc1ccc(CNCCCNC(=O)c2cc(-c3cccs3)[nH]n2)c(O)c1.Cc1coc(CN(CCCNC(=O)c2cc(-c3cccs3)[nH]n2)Cc2cc(C)no2)c1.O=C(NCCCNCC1=CCN=C1)c1cc(-c2cccs2)[nH]n1.O=C(NCCCNCc1c[nH]c2ncccc12)c1cc(-c2cccs2)[nH]n1.
What is the InChIKey of 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?
The InChIKey is MATBACNSUTUUES-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H29N5O3S.C22H25N5O3S.C22H23N5O2S.C19H20N6OS.C19H22N4O2S.C16H19N5O2S.C16H19N5OS/c1-33-21-7-3-6-19(12-21)17-31(18-20-13-22(34-2)16-27-15-20)10-5-9-28-26(32)24-14-23(29-30-24)25-8-4-11-35-25;1-15-9-17(29-14-15)12-27(13-18-10-16(2)26-30-18)7-4-6-23-22(28)20-11-19(24-25-20)21-5-3-8-31-21;1-15(28)27-14-16(17-6-2-3-7-20(17)27)13-23-9-5-10-24-22(29)19-12-18(25-26-19)21-8-4-11-30-21;26-19(16-10-15(24-25-16)17-5-2-9-27-17)22-8-3-6-20-11-13-12-23-18-14(13)4-1-7-21-18;1-13-5-6-14(17(24)10-13)12-20-7-3-8-21-19(25)16-11-15(22-23-16)18-4-2-9-26-18;1-11-8-12(23-21-11)10-17-5-3-6-18-16(22)14-9-13(19-20-14)15-4-2-7-24-15;22-16(14-9-13(20-21-14)15-3-1-8-23-15)19-6-2-5-17-10-12-4-7-18-11-12/h3-4,6-8,11-16H,5,9-10,17-18H2,1-2H3,(H,28,32)(H,29,30);3,5,8-11,14H,4,6-7,12-13H2,1-2H3,(H,23,28)(H,24,25);2-4,6-8,11-12,14,23H,5,9-10,13H2,1H3,(H,24,29)(H,25,26);1-2,4-5,7,9-10,12,20H,3,6,8,11H2,(H,21,23)(H,22,26)(H,24,25);2,4-6,9-11,20,24H,3,7-8,12H2,1H3,(H,21,25)(H,22,23);2,4,7-9,17H,3,5-6,10H2,1H3,(H,18,22)(H,19,20);1,3-4,8-9,11,17H,2,5-7,10H2,(H,19,22)(H,20,21).
What are the key properties of 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?
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 has a molecular weight of 2778.50 g/mol, XLogP of 22.38, 62 rotatable bonds, 21 hydrogen bond donors, and 41 hydrogen bond acceptors.
Where does this data come from?
All data for 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 is sourced from PubChem (CID 159512223), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).