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

C110H93FN16O11S6 — CID 158271076

IUPACN-[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
SMILESCOCCC(=O)Nc1ccc2[nH]nc(-c3cc4ccccc4s3)c2c1OC.COc1c(NC(=O)CCN(C)C)ccc2[nH]nc(-c3cc4ccccc4s3)c12.COc1c(NC(=O)Cc2cccs2)ccc2[nH]nc(-c3cc4ccccc4s3)c12.COc1c(NC(=O)c2cccs2)ccc2[nH]nc(-c3cc4ccccc4s3)c12.COc1cccc(C(=O)NCc2cc(F)c3n[nH]c(-c4ccc5ccccc5c4)c3c2)c1
InChIInChI=1S/C26H20FN3O2.C22H17N3O2S2.C21H22N4O2S.C21H15N3O2S2.C20H19N3O3S/c1-32-21-8-4-7-20(14-21)26(31)28-15-16-11-22-24(29-30-25(22)23(27)12-16)19-10-9-17-5-2-3-6-18(17)13-19;1-27-22-16(23-19(26)12-14-6-4-10-28-14)9-8-15-20(22)21(25-24-15)18-11-13-5-2-3-7-17(13)29-18;1-25(2)11-10-18(26)22-15-9-8-14-19(21(15)27-3)20(24-23-14)17-12-13-6-4-5-7-16(13)28-17;1-26-20-14(22-21(25)16-7-4-10-27-16)9-8-13-18(20)19(24-23-13)17-11-12-5-2-3-6-15(12)28-17;1-25-10-9-17(24)21-14-8-7-13-18(20(14)26-2)19(23-22-13)16-11-12-5-3-4-6-15(12)27-16/h2-14H,15H2,1H3,(H,28,31)(H,29,30);2-11H,12H2,1H3,(H,23,26)(H,24,25);4-9,12H,10-11H2,1-3H3,(H,22,26)(H,23,24);2-11H,1H3,(H,22,25)(H,23,24);3-8,11H,9-10H2,1-2H3,(H,21,24)(H,22,23)
InChIKeyGJAPDUAFPQGUCP-UHFFFAOYSA-N
MW2026.45 g/mol
LogP25.70
Rot. Bonds26

About 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

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 (PubChem CID 158271076) has the molecular formula C110H93FN16O11S6 and a molecular weight of 2026.45 g/mol. Its IUPAC name is 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.

Molecular Properties

Compound NameN-[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
PubChem CID158271076
Molecular FormulaC110H93FN16O11S6
Molecular Weight2026.45 g/mol
Exact Mass2024.55
IUPAC NameN-[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
SMILESCOCCC(=O)Nc1ccc2[nH]nc(-c3cc4ccccc4s3)c2c1OC.COc1c(NC(=O)CCN(C)C)ccc2[nH]nc(-c3cc4ccccc4s3)c12.COc1c(NC(=O)Cc2cccs2)ccc2[nH]nc(-c3cc4ccccc4s3)c12.COc1c(NC(=O)c2cccs2)ccc2[nH]nc(-c3cc4ccccc4s3)c12.COc1cccc(C(=O)NCc2cc(F)c3n[nH]c(-c4ccc5ccccc5c4)c3c2)c1
InChIInChI=1S/C26H20FN3O2.C22H17N3O2S2.C21H22N4O2S.C21H15N3O2S2.C20H19N3O3S/c1-32-21-8-4-7-20(14-21)26(31)28-15-16-11-22-24(29-30-25(22)23(27)12-16)19-10-9-17-5-2-3-6-18(17)13-19;1-27-22-16(23-19(26)12-14-6-4-10-28-14)9-8-15-20(22)21(25-24-15)18-11-13-5-2-3-7-17(13)29-18;1-25(2)11-10-18(26)22-15-9-8-14-19(21(15)27-3)20(24-23-14)17-12-13-6-4-5-7-16(13)28-17;1-26-20-14(22-21(25)16-7-4-10-27-16)9-8-13-18(20)19(24-23-13)17-11-12-5-2-3-6-15(12)28-17;1-25-10-9-17(24)21-14-8-7-13-18(20(14)26-2)19(23-22-13)16-11-12-5-3-4-6-15(12)27-16/h2-14H,15H2,1H3,(H,28,31)(H,29,30);2-11H,12H2,1H3,(H,23,26)(H,24,25);4-9,12H,10-11H2,1-3H3,(H,22,26)(H,23,24);2-11H,1H3,(H,22,25)(H,23,24);3-8,11H,9-10H2,1-2H3,(H,21,24)(H,22,23)
InChIKeyGJAPDUAFPQGUCP-UHFFFAOYSA-N
XLogP25.70
TPSA347.52 Ų
H-Bond Donors10
H-Bond Acceptors23
Rotatable Bonds26
Heavy Atoms144
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002026.45
LogP ≤ 525.70
H-Bond Donors ≤ 510
H-Bond Acceptors ≤ 1023

Analyze 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 with MolForge

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Frequently Asked Questions

What is the IUPAC name of 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?
The IUPAC name of 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) is 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.
What is the SMILES notation for 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?
The canonical SMILES for 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 is COCCC(=O)Nc1ccc2[nH]nc(-c3cc4ccccc4s3)c2c1OC.COc1c(NC(=O)CCN(C)C)ccc2[nH]nc(-c3cc4ccccc4s3)c12.COc1c(NC(=O)Cc2cccs2)ccc2[nH]nc(-c3cc4ccccc4s3)c12.COc1c(NC(=O)c2cccs2)ccc2[nH]nc(-c3cc4ccccc4s3)c12.COc1cccc(C(=O)NCc2cc(F)c3n[nH]c(-c4ccc5ccccc5c4)c3c2)c1.
What is the InChIKey of 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?
The InChIKey is GJAPDUAFPQGUCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H20FN3O2.C22H17N3O2S2.C21H22N4O2S.C21H15N3O2S2.C20H19N3O3S/c1-32-21-8-4-7-20(14-21)26(31)28-15-16-11-22-24(29-30-25(22)23(27)12-16)19-10-9-17-5-2-3-6-18(17)13-19;1-27-22-16(23-19(26)12-14-6-4-10-28-14)9-8-15-20(22)21(25-24-15)18-11-13-5-2-3-7-17(13)29-18;1-25(2)11-10-18(26)22-15-9-8-14-19(21(15)27-3)20(24-23-14)17-12-13-6-4-5-7-16(13)28-17;1-26-20-14(22-21(25)16-7-4-10-27-16)9-8-13-18(20)19(24-23-13)17-11-12-5-2-3-6-15(12)28-17;1-25-10-9-17(24)21-14-8-7-13-18(20(14)26-2)19(23-22-13)16-11-12-5-3-4-6-15(12)27-16/h2-14H,15H2,1H3,(H,28,31)(H,29,30);2-11H,12H2,1H3,(H,23,26)(H,24,25);4-9,12H,10-11H2,1-3H3,(H,22,26)(H,23,24);2-11H,1H3,(H,22,25)(H,23,24);3-8,11H,9-10H2,1-2H3,(H,21,24)(H,22,23).
What are the key properties of 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?
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 has a molecular weight of 2026.45 g/mol, XLogP of 25.70, 26 rotatable bonds, 10 hydrogen bond donors, and 23 hydrogen bond acceptors.
Where does this data come from?
All data for 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 is sourced from PubChem (CID 158271076), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).