(E)-N-[3-(1-benzothiophen-2-yl)-1H-indazol-5-yl]-3-cyclopropylprop-2-enamide;N-[3-(1-benzothiophen-2-yl)-1H-indazol-5-yl]-2,3-dihydro-1-benzofuran-7-carboxamide;N-[3-(1-benzothiophen-2-yl)-1H-indazol-5-yl]-3-thiophen-2-ylpropanamide;N-(3-naphthalen-2-yl-1H-indazol-5-yl)cyclopropanecarboxamide;N-(3-naphthalen-2-yl-1H-indazol-5-yl)thiophene-2-carboxamide

C110H83N15O6S5 — CID 158188335

IUPAC(E)-N-[3-(1-benzothiophen-2-yl)-1H-indazol-5-yl]-3-cyclopropylprop-2-enamide;N-[3-(1-benzothiophen-2-yl)-1H-indazol-5-yl]-2,3-dihydro-1-benzofuran-7-carboxamide;N-[3-(1-benzothiophen-2-yl)-1H-indazol-5-yl]-3-thiophen-2-ylpropanamide;N-(3-naphthalen-2-yl-1H-indazol-5-yl)cyclopropanecarboxamide;N-(3-naphthalen-2-yl-1H-indazol-5-yl)thiophene-2-carboxamide
SMILESO=C(/C=C/C1CC1)Nc1ccc2[nH]nc(-c3cc4ccccc4s3)c2c1.O=C(CCc1cccs1)Nc1ccc2[nH]nc(-c3cc4ccccc4s3)c2c1.O=C(Nc1ccc2[nH]nc(-c3cc4ccccc4s3)c2c1)c1cccc2c1OCC2.O=C(Nc1ccc2[nH]nc(-c3ccc4ccccc4c3)c2c1)C1CC1.O=C(Nc1ccc2[nH]nc(-c3ccc4ccccc4c3)c2c1)c1cccs1
InChIInChI=1S/C24H17N3O2S.C22H17N3OS2.C22H15N3OS.C21H17N3OS.C21H17N3O/c28-24(17-6-3-5-14-10-11-29-23(14)17)25-16-8-9-19-18(13-16)22(27-26-19)21-12-15-4-1-2-7-20(15)30-21;26-21(10-8-16-5-3-11-27-16)23-15-7-9-18-17(13-15)22(25-24-18)20-12-14-4-1-2-6-19(14)28-20;26-22(20-6-3-11-27-20)23-17-9-10-19-18(13-17)21(25-24-19)16-8-7-14-4-1-2-5-15(14)12-16;25-20(10-7-13-5-6-13)22-15-8-9-17-16(12-15)21(24-23-17)19-11-14-3-1-2-4-18(14)26-19;25-21(14-6-7-14)22-17-9-10-19-18(12-17)20(24-23-19)16-8-5-13-3-1-2-4-15(13)11-16/h1-9,12-13H,10-11H2,(H,25,28)(H,26,27);1-7,9,11-13H,8,10H2,(H,23,26)(H,24,25);1-13H,(H,23,26)(H,24,25);1-4,7-13H,5-6H2,(H,22,25)(H,23,24);1-5,8-12,14H,6-7H2,(H,22,25)(H,23,24)/b;;;10-7+;
InChIKeyFZKQYBPXDDZQOW-DGKSZRIPSA-N
MW1871.31 g/mol
LogP27.49
Rot. Bonds18

About (E)-N-[3-(1-benzothiophen-2-yl)-1H-indazol-5-yl]-3-cyclopropylprop-2-enamide;N-[3-(1-benzothiophen-2-yl)-1H-indazol-5-yl]-2,3-dihydro-1-benzofuran-7-carboxamide;N-[3-(1-benzothiophen-2-yl)-1H-indazol-5-yl]-3-thiophen-2-ylpropanamide;N-(3-naphthalen-2-yl-1H-indazol-5-yl)cyclopropanecarboxamide;N-(3-naphthalen-2-yl-1H-indazol-5-yl)thiophene-2-carboxamide

(E)-N-[3-(1-benzothiophen-2-yl)-1H-indazol-5-yl]-3-cyclopropylprop-2-enamide;N-[3-(1-benzothiophen-2-yl)-1H-indazol-5-yl]-2,3-dihydro-1-benzofuran-7-carboxamide;N-[3-(1-benzothiophen-2-yl)-1H-indazol-5-yl]-3-thiophen-2-ylpropanamide;N-(3-naphthalen-2-yl-1H-indazol-5-yl)cyclopropanecarboxamide;N-(3-naphthalen-2-yl-1H-indazol-5-yl)thiophene-2-carboxamide (PubChem CID 158188335) has the molecular formula C110H83N15O6S5 and a molecular weight of 1871.31 g/mol. Its IUPAC name is (E)-N-[3-(1-benzothiophen-2-yl)-1H-indazol-5-yl]-3-cyclopropylprop-2-enamide;N-[3-(1-benzothiophen-2-yl)-1H-indazol-5-yl]-2,3-dihydro-1-benzofuran-7-carboxamide;N-[3-(1-benzothiophen-2-yl)-1H-indazol-5-yl]-3-thiophen-2-ylpropanamide;N-(3-naphthalen-2-yl-1H-indazol-5-yl)cyclopropanecarboxamide;N-(3-naphthalen-2-yl-1H-indazol-5-yl)thiophene-2-carboxamide.

Molecular Properties

Compound Name(E)-N-[3-(1-benzothiophen-2-yl)-1H-indazol-5-yl]-3-cyclopropylprop-2-enamide;N-[3-(1-benzothiophen-2-yl)-1H-indazol-5-yl]-2,3-dihydro-1-benzofuran-7-carboxamide;N-[3-(1-benzothiophen-2-yl)-1H-indazol-5-yl]-3-thiophen-2-ylpropanamide;N-(3-naphthalen-2-yl-1H-indazol-5-yl)cyclopropanecarboxamide;N-(3-naphthalen-2-yl-1H-indazol-5-yl)thiophene-2-carboxamide
PubChem CID158188335
Molecular FormulaC110H83N15O6S5
Molecular Weight1871.31 g/mol
Exact Mass1869.53
IUPAC Name(E)-N-[3-(1-benzothiophen-2-yl)-1H-indazol-5-yl]-3-cyclopropylprop-2-enamide;N-[3-(1-benzothiophen-2-yl)-1H-indazol-5-yl]-2,3-dihydro-1-benzofuran-7-carboxamide;N-[3-(1-benzothiophen-2-yl)-1H-indazol-5-yl]-3-thiophen-2-ylpropanamide;N-(3-naphthalen-2-yl-1H-indazol-5-yl)cyclopropanecarboxamide;N-(3-naphthalen-2-yl-1H-indazol-5-yl)thiophene-2-carboxamide
SMILESO=C(/C=C/C1CC1)Nc1ccc2[nH]nc(-c3cc4ccccc4s3)c2c1.O=C(CCc1cccs1)Nc1ccc2[nH]nc(-c3cc4ccccc4s3)c2c1.O=C(Nc1ccc2[nH]nc(-c3cc4ccccc4s3)c2c1)c1cccc2c1OCC2.O=C(Nc1ccc2[nH]nc(-c3ccc4ccccc4c3)c2c1)C1CC1.O=C(Nc1ccc2[nH]nc(-c3ccc4ccccc4c3)c2c1)c1cccs1
InChIInChI=1S/C24H17N3O2S.C22H17N3OS2.C22H15N3OS.C21H17N3OS.C21H17N3O/c28-24(17-6-3-5-14-10-11-29-23(14)17)25-16-8-9-19-18(13-16)22(27-26-19)21-12-15-4-1-2-7-20(15)30-21;26-21(10-8-16-5-3-11-27-16)23-15-7-9-18-17(13-15)22(25-24-18)20-12-14-4-1-2-6-19(14)28-20;26-22(20-6-3-11-27-20)23-17-9-10-19-18(13-17)21(25-24-19)16-8-7-14-4-1-2-5-15(14)12-16;25-20(10-7-13-5-6-13)22-15-8-9-17-16(12-15)21(24-23-17)19-11-14-3-1-2-4-18(14)26-19;25-21(14-6-7-14)22-17-9-10-19-18(12-17)20(24-23-19)16-8-5-13-3-1-2-4-15(13)11-16/h1-9,12-13H,10-11H2,(H,25,28)(H,26,27);1-7,9,11-13H,8,10H2,(H,23,26)(H,24,25);1-13H,(H,23,26)(H,24,25);1-4,7-13H,5-6H2,(H,22,25)(H,23,24);1-5,8-12,14H,6-7H2,(H,22,25)(H,23,24)/b;;;10-7+;
InChIKeyFZKQYBPXDDZQOW-DGKSZRIPSA-N
XLogP27.49
TPSA298.13 Ų
H-Bond Donors10
H-Bond Acceptors16
Rotatable Bonds18
Heavy Atoms136
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001871.31
LogP ≤ 527.49
H-Bond Donors ≤ 510
H-Bond Acceptors ≤ 1016

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

Analyze (E)-N-[3-(1-benzothiophen-2-yl)-1H-indazol-5-yl]-3-cyclopropylprop-2-enamide;N-[3-(1-benzothiophen-2-yl)-1H-indazol-5-yl]-2,3-dihydro-1-benzofuran-7-carboxamide;N-[3-(1-benzothiophen-2-yl)-1H-indazol-5-yl]-3-thiophen-2-ylpropanamide;N-(3-naphthalen-2-yl-1H-indazol-5-yl)cyclopropanecarboxamide;N-(3-naphthalen-2-yl-1H-indazol-5-yl)thiophene-2-carboxamide with MolForge

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Related Compounds

(2R)-2-amino-N-[3-(1-benzofuran-2-yl)-1H-indazol-5-yl]-3,3-dimethylbutanamide;(2R)-2-amino-N-[3-(1-benzofuran-2-yl)-1H-indazol-5-yl]-3-phenylmethoxypropanamide;(2R)-2-amino-N-[3-(1-benzothiophen-2-yl)-1H-indazol-5-yl]-3-methylbutanamide;(2R)-2-amino-N-[3-(1-benzothiophen-2-yl)-1H-indazol-5-yl]-3-phenylpropanamide;(2R)-2-amino-N-[3-[3,5-bis(trifluoromethyl)phenyl]-1H-indazol-5-yl]-3,3-diphenylpropanamide;N-[3-(3-phenylphenyl)-1H-indazol-5-yl]-1,2,3,4-tetrahydronaphthalene-2-carboxamide
CID 157307552
N-[3-(1-benzothiophen-2-yl)-1H-indazol-5-yl]-2,3-dihydro-1-benzofuran-7-carboxamide
CID 22260994
N-[3-(4-acetylphenyl)-1H-indazol-5-yl]-3-phenoxypropanamide;N-[3-(1-benzofuran-2-yl)-1H-indazol-5-yl]-3-oxo-1,2-dihydroindene-1-carboxamide;N-[3-(1-benzothiophen-2-yl)-1H-indazol-5-yl]oxolane-3-carboxamide;3-hydroxy-2-(hydroxymethyl)-2-methyl-N-(3-naphthalen-2-yl-1H-indazol-5-yl)propanamide;N-(3-naphthalen-2-yl-1H-indazol-5-yl)-2-(2-oxocyclopentyl)acetamide
CID 157341591
N-(7-fluoro-3-naphthalen-2-yl-2H-indazol-5-yl)oxolane-2-carboxamide;N-(7-fluoro-3-naphthalen-2-yl-2H-indazol-5-yl)-2-thiophen-2-ylacetamide;N-(7-fluoro-3-naphthalen-2-yl-2H-indazol-5-yl)-2-thiophen-3-ylacetamide;N-(4-methoxy-3-naphthalen-2-yl-1H-indazol-5-yl)acetamide;N-(4-methoxy-3-naphthalen-2-yl-1H-indazol-5-yl)cyclopropanecarboxamide
CID 158192964
N-[3-(1-benzothiophen-2-yl)-4-methoxy-1H-indazol-5-yl]-3-(dimethylamino)propanamide;N-[3-(1-benzothiophen-2-yl)-4-methoxy-1H-indazol-5-yl]-3-methoxypropanamide;N-[3-(1-benzothiophen-2-yl)-4-methoxy-1H-indazol-5-yl]thiophene-2-carboxamide;N-[3-(1-benzothiophen-2-yl)-4-methoxy-1H-indazol-5-yl]-2-thiophen-2-ylacetamide;N-[(7-fluoro-3-naphthalen-2-yl-2H-indazol-5-yl)methyl]-3-methoxybenzamide
CID 158271076
(E)-N-[3-(1-benzothiophen-2-yl)-1H-indazol-5-yl]-3-cyclopropylprop-2-enamide;N-[3-(1-benzothiophen-2-yl)-1H-indazol-5-yl]-3-thiophen-2-ylpropanamide;N-[3-[3-(cyclopropanecarbonylamino)phenyl]-1H-indazol-5-yl]cyclopropanecarboxamide;8-hydroxy-N-(3-naphthalen-2-yl-1H-indazol-5-yl)octanamide;N-(3-naphthalen-2-yl-1H-indazol-5-yl)cyclopropanecarboxamide;N-(3-naphthalen-2-yl-1H-indazol-5-yl)thiophene-2-carboxamide
CID 159268560
N-(7-fluoro-3-naphthalen-2-yl-2H-indazol-5-yl)-2-thiophen-2-ylacetamide;N-(4-methoxy-3-naphthalen-2-yl-1H-indazol-5-yl)acetamide;N-(4-methoxy-3-naphthalen-2-yl-1H-indazol-5-yl)cyclopropanecarboxamide
CID 159592790
N-[3-(4-acetylphenyl)-1H-indazol-5-yl]-3-phenoxypropanamide;N-[3-(1-benzofuran-2-yl)-1H-indazol-5-yl]-3-oxo-1,2-dihydroindene-1-carboxamide;N-[3-(1-benzothiophen-2-yl)-1H-indazol-5-yl]-3-methoxypropanamide;N-[3-(1-benzothiophen-2-yl)-1H-indazol-5-yl]oxolane-3-carboxamide;3-hydroxy-2-(hydroxymethyl)-2-methyl-N-(3-naphthalen-2-yl-1H-indazol-5-yl)propanamide
CID 159785365
N-[3-(1-benzothiophen-2-yl)-1H-indazol-5-yl]-4-hydroxycyclohexane-1-carboxamide;4-(hydroxymethyl)-N-(3-naphthalen-2-yl-1H-indazol-5-yl)benzamide;4-hydroxy-N-(3-naphthalen-2-yl-1H-indazol-5-yl)-5-phenylpentanamide;4-methoxy-N-(3-naphthalen-2-yl-1H-indazol-5-yl)cyclohexane-1-carboxamide;3-oxo-N-[3-(4-phenylmethoxyphenyl)-1H-indazol-5-yl]cyclopentane-1-carboxamide
CID 160049107
N-[3-(1-benzothiophen-2-yl)-1H-indazol-5-yl]cyclopentanecarboxamide;(E)-N-[3-(1-benzothiophen-2-yl)-1H-indazol-5-yl]-3-cyclopropylprop-2-enamide;N-[3-(1-benzothiophen-2-yl)-1H-indazol-5-yl]-2,3-dihydro-1-benzofuran-7-carboxamide;N-[3-(1-benzothiophen-2-yl)-1H-indazol-5-yl]-3-thiophen-2-ylpropanamide;2-(2,4-dichlorophenyl)-N-[3-(4-methylsulfonylphenyl)-1H-indazol-5-yl]acetamide
CID 160800338
N-[3-[3-(cyclopropanecarbonylamino)phenyl]-1H-indazol-5-yl]cyclopropanecarboxamide;8-hydroxy-N-(3-naphthalen-2-yl-1H-indazol-5-yl)octanamide;N-(3-naphthalen-2-yl-1H-indazol-5-yl)cyclopropanecarboxamide;N-(3-naphthalen-2-yl-1H-indazol-5-yl)thiophene-2-carboxamide;3-oxo-N-[3-(4-phenylmethoxyphenyl)-1H-indazol-5-yl]cyclopentane-1-carboxamide
CID 161020685

Frequently Asked Questions

What is the IUPAC name of (E)-N-[3-(1-benzothiophen-2-yl)-1H-indazol-5-yl]-3-cyclopropylprop-2-enamide;N-[3-(1-benzothiophen-2-yl)-1H-indazol-5-yl]-2,3-dihydro-1-benzofuran-7-carboxamide;N-[3-(1-benzothiophen-2-yl)-1H-indazol-5-yl]-3-thiophen-2-ylpropanamide;N-(3-naphthalen-2-yl-1H-indazol-5-yl)cyclopropanecarboxamide;N-(3-naphthalen-2-yl-1H-indazol-5-yl)thiophene-2-carboxamide?
The IUPAC name of (E)-N-[3-(1-benzothiophen-2-yl)-1H-indazol-5-yl]-3-cyclopropylprop-2-enamide;N-[3-(1-benzothiophen-2-yl)-1H-indazol-5-yl]-2,3-dihydro-1-benzofuran-7-carboxamide;N-[3-(1-benzothiophen-2-yl)-1H-indazol-5-yl]-3-thiophen-2-ylpropanamide;N-(3-naphthalen-2-yl-1H-indazol-5-yl)cyclopropanecarboxamide;N-(3-naphthalen-2-yl-1H-indazol-5-yl)thiophene-2-carboxamide (CID 158188335) is (E)-N-[3-(1-benzothiophen-2-yl)-1H-indazol-5-yl]-3-cyclopropylprop-2-enamide;N-[3-(1-benzothiophen-2-yl)-1H-indazol-5-yl]-2,3-dihydro-1-benzofuran-7-carboxamide;N-[3-(1-benzothiophen-2-yl)-1H-indazol-5-yl]-3-thiophen-2-ylpropanamide;N-(3-naphthalen-2-yl-1H-indazol-5-yl)cyclopropanecarboxamide;N-(3-naphthalen-2-yl-1H-indazol-5-yl)thiophene-2-carboxamide.
What is the SMILES notation for (E)-N-[3-(1-benzothiophen-2-yl)-1H-indazol-5-yl]-3-cyclopropylprop-2-enamide;N-[3-(1-benzothiophen-2-yl)-1H-indazol-5-yl]-2,3-dihydro-1-benzofuran-7-carboxamide;N-[3-(1-benzothiophen-2-yl)-1H-indazol-5-yl]-3-thiophen-2-ylpropanamide;N-(3-naphthalen-2-yl-1H-indazol-5-yl)cyclopropanecarboxamide;N-(3-naphthalen-2-yl-1H-indazol-5-yl)thiophene-2-carboxamide?
The canonical SMILES for (E)-N-[3-(1-benzothiophen-2-yl)-1H-indazol-5-yl]-3-cyclopropylprop-2-enamide;N-[3-(1-benzothiophen-2-yl)-1H-indazol-5-yl]-2,3-dihydro-1-benzofuran-7-carboxamide;N-[3-(1-benzothiophen-2-yl)-1H-indazol-5-yl]-3-thiophen-2-ylpropanamide;N-(3-naphthalen-2-yl-1H-indazol-5-yl)cyclopropanecarboxamide;N-(3-naphthalen-2-yl-1H-indazol-5-yl)thiophene-2-carboxamide is O=C(/C=C/C1CC1)Nc1ccc2[nH]nc(-c3cc4ccccc4s3)c2c1.O=C(CCc1cccs1)Nc1ccc2[nH]nc(-c3cc4ccccc4s3)c2c1.O=C(Nc1ccc2[nH]nc(-c3cc4ccccc4s3)c2c1)c1cccc2c1OCC2.O=C(Nc1ccc2[nH]nc(-c3ccc4ccccc4c3)c2c1)C1CC1.O=C(Nc1ccc2[nH]nc(-c3ccc4ccccc4c3)c2c1)c1cccs1.
What is the InChIKey of (E)-N-[3-(1-benzothiophen-2-yl)-1H-indazol-5-yl]-3-cyclopropylprop-2-enamide;N-[3-(1-benzothiophen-2-yl)-1H-indazol-5-yl]-2,3-dihydro-1-benzofuran-7-carboxamide;N-[3-(1-benzothiophen-2-yl)-1H-indazol-5-yl]-3-thiophen-2-ylpropanamide;N-(3-naphthalen-2-yl-1H-indazol-5-yl)cyclopropanecarboxamide;N-(3-naphthalen-2-yl-1H-indazol-5-yl)thiophene-2-carboxamide?
The InChIKey is FZKQYBPXDDZQOW-DGKSZRIPSA-N. The full InChI is InChI=1S/C24H17N3O2S.C22H17N3OS2.C22H15N3OS.C21H17N3OS.C21H17N3O/c28-24(17-6-3-5-14-10-11-29-23(14)17)25-16-8-9-19-18(13-16)22(27-26-19)21-12-15-4-1-2-7-20(15)30-21;26-21(10-8-16-5-3-11-27-16)23-15-7-9-18-17(13-15)22(25-24-18)20-12-14-4-1-2-6-19(14)28-20;26-22(20-6-3-11-27-20)23-17-9-10-19-18(13-17)21(25-24-19)16-8-7-14-4-1-2-5-15(14)12-16;25-20(10-7-13-5-6-13)22-15-8-9-17-16(12-15)21(24-23-17)19-11-14-3-1-2-4-18(14)26-19;25-21(14-6-7-14)22-17-9-10-19-18(12-17)20(24-23-19)16-8-5-13-3-1-2-4-15(13)11-16/h1-9,12-13H,10-11H2,(H,25,28)(H,26,27);1-7,9,11-13H,8,10H2,(H,23,26)(H,24,25);1-13H,(H,23,26)(H,24,25);1-4,7-13H,5-6H2,(H,22,25)(H,23,24);1-5,8-12,14H,6-7H2,(H,22,25)(H,23,24)/b;;;10-7+;.
What are the key properties of (E)-N-[3-(1-benzothiophen-2-yl)-1H-indazol-5-yl]-3-cyclopropylprop-2-enamide;N-[3-(1-benzothiophen-2-yl)-1H-indazol-5-yl]-2,3-dihydro-1-benzofuran-7-carboxamide;N-[3-(1-benzothiophen-2-yl)-1H-indazol-5-yl]-3-thiophen-2-ylpropanamide;N-(3-naphthalen-2-yl-1H-indazol-5-yl)cyclopropanecarboxamide;N-(3-naphthalen-2-yl-1H-indazol-5-yl)thiophene-2-carboxamide?
(E)-N-[3-(1-benzothiophen-2-yl)-1H-indazol-5-yl]-3-cyclopropylprop-2-enamide;N-[3-(1-benzothiophen-2-yl)-1H-indazol-5-yl]-2,3-dihydro-1-benzofuran-7-carboxamide;N-[3-(1-benzothiophen-2-yl)-1H-indazol-5-yl]-3-thiophen-2-ylpropanamide;N-(3-naphthalen-2-yl-1H-indazol-5-yl)cyclopropanecarboxamide;N-(3-naphthalen-2-yl-1H-indazol-5-yl)thiophene-2-carboxamide has a molecular weight of 1871.31 g/mol, XLogP of 27.49, 18 rotatable bonds, 10 hydrogen bond donors, and 16 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-N-[3-(1-benzothiophen-2-yl)-1H-indazol-5-yl]-3-cyclopropylprop-2-enamide;N-[3-(1-benzothiophen-2-yl)-1H-indazol-5-yl]-2,3-dihydro-1-benzofuran-7-carboxamide;N-[3-(1-benzothiophen-2-yl)-1H-indazol-5-yl]-3-thiophen-2-ylpropanamide;N-(3-naphthalen-2-yl-1H-indazol-5-yl)cyclopropanecarboxamide;N-(3-naphthalen-2-yl-1H-indazol-5-yl)thiophene-2-carboxamide is sourced from PubChem (CID 158188335), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).