2-[(4-acetamido-3-pyridinyl)oxy]-N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]acetamide;2-(4-aminoquinazolin-8-yl)oxy-N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]acetamide;N-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-hydroxybutan-2-yl]-2-(2-sulfamoylphenoxy)acetamide;6-(3,4-dihydro-1H-isoquinolin-2-yl)-5-hydroxy-1-(2-morpholin-4-ylethoxy)hexan-2-one;6-(3,4-dihydro-1H-isoquinolin-2-yl)-5-hydroxy-1-[[5-(morpholin-4-ylmethyl)-3-pyridinyl]oxy]hexan-2-one;N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]-2-[3-(dimethylamino)-2-sulfamoylphenoxy]acetamide;N-[(2S)-3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]-2-(1,3-dimethylindol-4-yl)oxyacetamide;N-[(2R)-3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]-2-(1,3-dimethylindol-4-yl)oxyacetamide;N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]-2-hydroxy-2-phenylacetamide;N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]-2-(oxan-3-yloxy)acetamide;N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]-2-(oxolan-3-yloxy)acetamide

C237H309N33O42S2 — CID 161297074

About 2-[(4-acetamido-3-pyridinyl)oxy]-N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]acetamide;2-(4-aminoquinazolin-8-yl)oxy-N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]acetamide;N-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-hydroxybutan-2-yl]-2-(2-sulfamoylphenoxy)acetamide;6-(3,4-dihydro-1H-isoquinolin-2-yl)-5-hydroxy-1-(2-morpholin-4-ylethoxy)hexan-2-one;6-(3,4-dihydro-1H-isoquinolin-2-yl)-5-hydroxy-1-[[5-(morpholin-4-ylmethyl)-3-pyridinyl]oxy]hexan-2-one;N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]-2-[3-(dimethylamino)-2-sulfamoylphenoxy]acetamide;N-[(2S)-3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]-2-(1,3-dimethylindol-4-yl)oxyacetamide;N-[(2R)-3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]-2-(1,3-dimethylindol-4-yl)oxyacetamide;N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]-2-hydroxy-2-phenylacetamide;N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]-2-(oxan-3-yloxy)acetamide;N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]-2-(oxolan-3-yloxy)acetamide

2-[(4-acetamido-3-pyridinyl)oxy]-N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]acetamide;2-(4-aminoquinazolin-8-yl)oxy-N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]acetamide;N-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-hydroxybutan-2-yl]-2-(2-sulfamoylphenoxy)acetamide;6-(3,4-dihydro-1H-isoquinolin-2-yl)-5-hydroxy-1-(2-morpholin-4-ylethoxy)hexan-2-one;6-(3,4-dihydro-1H-isoquinolin-2-yl)-5-hydroxy-1-[[5-(morpholin-4-ylmethyl)-3-pyridinyl]oxy]hexan-2-one;N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]-2-[3-(dimethylamino)-2-sulfamoylphenoxy]acetamide;N-[(2S)-3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]-2-(1,3-dimethylindol-4-yl)oxyacetamide;N-[(2R)-3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]-2-(1,3-dimethylindol-4-yl)oxyacetamide;N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]-2-hydroxy-2-phenylacetamide;N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]-2-(oxan-3-yloxy)acetamide;N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]-2-(oxolan-3-yloxy)acetamide (PubChem CID 161297074) has the molecular formula C237H309N33O42S2 and a molecular weight of 4356.40 g/mol. Its IUPAC name is 2-[(4-acetamido-3-pyridinyl)oxy]-N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]acetamide;2-(4-aminoquinazolin-8-yl)oxy-N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]acetamide;N-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-hydroxybutan-2-yl]-2-(2-sulfamoylphenoxy)acetamide;6-(3,4-dihydro-1H-isoquinolin-2-yl)-5-hydroxy-1-(2-morpholin-4-ylethoxy)hexan-2-one;6-(3,4-dihydro-1H-isoquinolin-2-yl)-5-hydroxy-1-[[5-(morpholin-4-ylmethyl)-3-pyridinyl]oxy]hexan-2-one;N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]-2-[3-(dimethylamino)-2-sulfamoylphenoxy]acetamide;N-[(2S)-3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]-2-(1,3-dimethylindol-4-yl)oxyacetamide;N-[(2R)-3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]-2-(1,3-dimethylindol-4-yl)oxyacetamide;N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]-2-hydroxy-2-phenylacetamide;N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]-2-(oxan-3-yloxy)acetamide;N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]-2-(oxolan-3-yloxy)acetamide.

Molecular Properties

• Compound Name: 2-[(4-acetamido-3-pyridinyl)oxy]-N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]acetamide;2-(4-aminoquinazolin-8-yl)oxy-N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]acetamide;N-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-hydroxybutan-2-yl]-2-(2-sulfamoylphenoxy)acetamide;6-(3,4-dihydro-1H-isoquinolin-2-yl)-5-hydroxy-1-(2-morpholin-4-ylethoxy)hexan-2-one;6-(3,4-dihydro-1H-isoquinolin-2-yl)-5-hydroxy-1-[[5-(morpholin-4-ylmethyl)-3-pyridinyl]oxy]hexan-2-one;N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]-2-[3-(dimethylamino)-2-sulfamoylphenoxy]acetamide;N-[(2S)-3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]-2-(1,3-dimethylindol-4-yl)oxyacetamide;N-[(2R)-3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]-2-(1,3-dimethylindol-4-yl)oxyacetamide;N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]-2-hydroxy-2-phenylacetamide;N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]-2-(oxan-3-yloxy)acetamide;N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]-2-(oxolan-3-yloxy)acetamide
• PubChem CID: 161297074
• Molecular Formula: C237H309N33O42S2
• Molecular Weight: 4356.40 g/mol
• Exact Mass: 4353.25
• IUPAC Name: 2-[(4-acetamido-3-pyridinyl)oxy]-N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]acetamide;2-(4-aminoquinazolin-8-yl)oxy-N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]acetamide;N-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-hydroxybutan-2-yl]-2-(2-sulfamoylphenoxy)acetamide;6-(3,4-dihydro-1H-isoquinolin-2-yl)-5-hydroxy-1-(2-morpholin-4-ylethoxy)hexan-2-one;6-(3,4-dihydro-1H-isoquinolin-2-yl)-5-hydroxy-1-[[5-(morpholin-4-ylmethyl)-3-pyridinyl]oxy]hexan-2-one;N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]-2-[3-(dimethylamino)-2-sulfamoylphenoxy]acetamide;N-[(2S)-3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]-2-(1,3-dimethylindol-4-yl)oxyacetamide;N-[(2R)-3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]-2-(1,3-dimethylindol-4-yl)oxyacetamide;N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]-2-hydroxy-2-phenylacetamide;N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]-2-(oxan-3-yloxy)acetamide;N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]-2-(oxolan-3-yloxy)acetamide
• SMILES: CC(=O)Nc1ccncc1OCC(=O)NCC(O)CN1CCc2ccccc2C1.CC(NC(=O)COc1ccccc1S(N)(=O)=O)C(O)CN1CCc2ccccc2C1.CN(C)c1cccc(OCC(=O)NCC(O)CN2CCc3ccccc3C2)c1S(N)(=O)=O.Cc1cn(C)c2cccc(OCC(=O)NC[C@@H](O)CN3CCc4ccccc4C3)c12.Cc1cn(C)c2cccc(OCC(=O)NC[C@H](O)CN3CCc4ccccc4C3)c12.Nc1ncnc2c(OCC(=O)NCC(O)CN3CCc4ccccc4C3)cccc12.O=C(CCC(O)CN1CCc2ccccc2C1)COCCN1CCOCC1.O=C(CCC(O)CN1CCc2ccccc2C1)COc1cncc(CN2CCOCC2)c1.O=C(COC1CCCOC1)NCC(O)CN1CCc2ccccc2C1.O=C(COC1CCOC1)NCC(O)CN1CCc2ccccc2C1.O=C(NCC(O)CN1CCc2ccccc2C1)C(O)c1ccccc1
• InChI: InChI=1S/C25H33N3O4.2C24H29N3O3.C22H25N5O3.C22H30N4O5S.C21H26N4O4.C21H27N3O5S.C21H32N2O4.C20H24N2O3.C19H28N2O4.C18H26N2O4/c29-23(18-28-8-7-21-3-1-2-4-22(21)17-28)5-6-24(30)19-32-25-13-20(14-26-15-25)16-27-9-11-31-12-10-27;2*1-17-13-26(2)21-8-5-9-22(24(17)21)30-16-23(29)25-12-20(28)15-27-11-10-18-6-3-4-7-19(18)14-27;23-22-18-6-3-7-19(21(18)25-14-26-22)30-13-20(29)24-10-17(28)12-27-9-8-15-4-1-2-5-16(15)11-27;1-25(2)19-8-5-9-20(22(19)32(23,29)30)31-15-21(28)24-12-18(27)14-26-11-10-16-6-3-4-7-17(16)13-26;1-15(26)24-19-6-8-22-11-20(19)29-14-21(28)23-10-18(27)13-25-9-7-16-4-2-3-5-17(16)12-25;1-15(18(25)13-24-11-10-16-6-2-3-7-17(16)12-24)23-21(26)14-29-19-8-4-5-9-20(19)30(22,27)28;24-20(16-23-8-7-18-3-1-2-4-19(18)15-23)5-6-21(25)17-27-14-11-22-9-12-26-13-10-22;23-18(12-21-20(25)19(24)16-7-2-1-3-8-16)14-22-11-10-15-6-4-5-9-17(15)13-22;22-17(10-20-19(23)14-25-18-6-3-9-24-13-18)12-21-8-7-15-4-1-2-5-16(15)11-21;21-16(9-19-18(22)13-24-17-6-8-23-12-17)11-20-7-5-14-3-1-2-4-15(14)10-20/h1-4,13-15,23,29H,5-12,16-19H2;2*3-9,13,20,28H,10-12,14-16H2,1-2H3,(H,25,29);1-7,14,17,28H,8-13H2,(H,24,29)(H2,23,25,26);3-9,18,27H,10-15H2,1-2H3,(H,24,28)(H2,23,29,30);2-6,8,11,18,27H,7,9-10,12-14H2,1H3,(H,23,28)(H,22,24,26);2-9,15,18,25H,10-14H2,1H3,(H,23,26)(H2,22,27,28);1-4,20,24H,5-17H2;1-9,18-19,23-24H,10-14H2,(H,21,25);1-2,4-5,17-18,22H,3,6-14H2,(H,20,23);1-4,16-17,21H,5-13H2,(H,19,22)/t;2*20-;;;;;;;;/m.10......../s1
• InChIKey: VHCOSQCSLHJPIX-SMWLZWQYSA-N
• XLogP: 13.30
• TPSA: 950.24 Ų
• H-Bond Donors: 25
• H-Bond Acceptors: 63
• Rotatable Bonds: 86
• Heavy Atoms: 314
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	4356.40
LogP ≤ 5	13.30
H-Bond Donors ≤ 5	25
H-Bond Acceptors ≤ 10	63

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2-[(4-acetamido-3-pyridinyl)oxy]-N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]acetamide;2-(4-aminoquinazolin-8-yl)oxy-N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]acetamide;N-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-hydroxybutan-2-yl]-2-(2-sulfamoylphenoxy)acetamide;6-(3,4-dihydro-1H-isoquinolin-2-yl)-5-hydroxy-1-(2-morpholin-4-ylethoxy)hexan-2-one;6-(3,4-dihydro-1H-isoquinolin-2-yl)-5-hydroxy-1-[[5-(morpholin-4-ylmethyl)-3-pyridinyl]oxy]hexan-2-one;N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]-2-[3-(dimethylamino)-2-sulfamoylphenoxy]acetamide;N-[(2S)-3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]-2-(1,3-dimethylindol-4-yl)oxyacetamide;N-[(2R)-3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]-2-(1,3-dimethylindol-4-yl)oxyacetamide;N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]-2-hydroxy-2-phenylacetamide;N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]-2-(oxan-3-yloxy)acetamide;N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]-2-(oxolan-3-yloxy)acetamide?

The IUPAC name of 2-[(4-acetamido-3-pyridinyl)oxy]-N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]acetamide;2-(4-aminoquinazolin-8-yl)oxy-N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]acetamide;N-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-hydroxybutan-2-yl]-2-(2-sulfamoylphenoxy)acetamide;6-(3,4-dihydro-1H-isoquinolin-2-yl)-5-hydroxy-1-(2-morpholin-4-ylethoxy)hexan-2-one;6-(3,4-dihydro-1H-isoquinolin-2-yl)-5-hydroxy-1-[[5-(morpholin-4-ylmethyl)-3-pyridinyl]oxy]hexan-2-one;N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]-2-[3-(dimethylamino)-2-sulfamoylphenoxy]acetamide;N-[(2S)-3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]-2-(1,3-dimethylindol-4-yl)oxyacetamide;N-[(2R)-3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]-2-(1,3-dimethylindol-4-yl)oxyacetamide;N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]-2-hydroxy-2-phenylacetamide;N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]-2-(oxan-3-yloxy)acetamide;N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]-2-(oxolan-3-yloxy)acetamide (CID 161297074) is 2-[(4-acetamido-3-pyridinyl)oxy]-N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]acetamide;2-(4-aminoquinazolin-8-yl)oxy-N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]acetamide;N-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-hydroxybutan-2-yl]-2-(2-sulfamoylphenoxy)acetamide;6-(3,4-dihydro-1H-isoquinolin-2-yl)-5-hydroxy-1-(2-morpholin-4-ylethoxy)hexan-2-one;6-(3,4-dihydro-1H-isoquinolin-2-yl)-5-hydroxy-1-[[5-(morpholin-4-ylmethyl)-3-pyridinyl]oxy]hexan-2-one;N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]-2-[3-(dimethylamino)-2-sulfamoylphenoxy]acetamide;N-[(2S)-3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]-2-(1,3-dimethylindol-4-yl)oxyacetamide;N-[(2R)-3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]-2-(1,3-dimethylindol-4-yl)oxyacetamide;N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]-2-hydroxy-2-phenylacetamide;N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]-2-(oxan-3-yloxy)acetamide;N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]-2-(oxolan-3-yloxy)acetamide.

What is the SMILES notation for 2-[(4-acetamido-3-pyridinyl)oxy]-N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]acetamide;2-(4-aminoquinazolin-8-yl)oxy-N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]acetamide;N-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-hydroxybutan-2-yl]-2-(2-sulfamoylphenoxy)acetamide;6-(3,4-dihydro-1H-isoquinolin-2-yl)-5-hydroxy-1-(2-morpholin-4-ylethoxy)hexan-2-one;6-(3,4-dihydro-1H-isoquinolin-2-yl)-5-hydroxy-1-[[5-(morpholin-4-ylmethyl)-3-pyridinyl]oxy]hexan-2-one;N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]-2-[3-(dimethylamino)-2-sulfamoylphenoxy]acetamide;N-[(2S)-3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]-2-(1,3-dimethylindol-4-yl)oxyacetamide;N-[(2R)-3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]-2-(1,3-dimethylindol-4-yl)oxyacetamide;N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]-2-hydroxy-2-phenylacetamide;N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]-2-(oxan-3-yloxy)acetamide;N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]-2-(oxolan-3-yloxy)acetamide?

The canonical SMILES for 2-[(4-acetamido-3-pyridinyl)oxy]-N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]acetamide;2-(4-aminoquinazolin-8-yl)oxy-N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]acetamide;N-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-hydroxybutan-2-yl]-2-(2-sulfamoylphenoxy)acetamide;6-(3,4-dihydro-1H-isoquinolin-2-yl)-5-hydroxy-1-(2-morpholin-4-ylethoxy)hexan-2-one;6-(3,4-dihydro-1H-isoquinolin-2-yl)-5-hydroxy-1-[[5-(morpholin-4-ylmethyl)-3-pyridinyl]oxy]hexan-2-one;N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]-2-[3-(dimethylamino)-2-sulfamoylphenoxy]acetamide;N-[(2S)-3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]-2-(1,3-dimethylindol-4-yl)oxyacetamide;N-[(2R)-3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]-2-(1,3-dimethylindol-4-yl)oxyacetamide;N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]-2-hydroxy-2-phenylacetamide;N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]-2-(oxan-3-yloxy)acetamide;N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]-2-(oxolan-3-yloxy)acetamide is CC(=O)Nc1ccncc1OCC(=O)NCC(O)CN1CCc2ccccc2C1.CC(NC(=O)COc1ccccc1S(N)(=O)=O)C(O)CN1CCc2ccccc2C1.CN(C)c1cccc(OCC(=O)NCC(O)CN2CCc3ccccc3C2)c1S(N)(=O)=O.Cc1cn(C)c2cccc(OCC(=O)NC[C@@H](O)CN3CCc4ccccc4C3)c12.Cc1cn(C)c2cccc(OCC(=O)NC[C@H](O)CN3CCc4ccccc4C3)c12.Nc1ncnc2c(OCC(=O)NCC(O)CN3CCc4ccccc4C3)cccc12.O=C(CCC(O)CN1CCc2ccccc2C1)COCCN1CCOCC1.O=C(CCC(O)CN1CCc2ccccc2C1)COc1cncc(CN2CCOCC2)c1.O=C(COC1CCCOC1)NCC(O)CN1CCc2ccccc2C1.O=C(COC1CCOC1)NCC(O)CN1CCc2ccccc2C1.O=C(NCC(O)CN1CCc2ccccc2C1)C(O)c1ccccc1.

What is the InChIKey of 2-[(4-acetamido-3-pyridinyl)oxy]-N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]acetamide;2-(4-aminoquinazolin-8-yl)oxy-N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]acetamide;N-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-hydroxybutan-2-yl]-2-(2-sulfamoylphenoxy)acetamide;6-(3,4-dihydro-1H-isoquinolin-2-yl)-5-hydroxy-1-(2-morpholin-4-ylethoxy)hexan-2-one;6-(3,4-dihydro-1H-isoquinolin-2-yl)-5-hydroxy-1-[[5-(morpholin-4-ylmethyl)-3-pyridinyl]oxy]hexan-2-one;N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]-2-[3-(dimethylamino)-2-sulfamoylphenoxy]acetamide;N-[(2S)-3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]-2-(1,3-dimethylindol-4-yl)oxyacetamide;N-[(2R)-3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]-2-(1,3-dimethylindol-4-yl)oxyacetamide;N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]-2-hydroxy-2-phenylacetamide;N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]-2-(oxan-3-yloxy)acetamide;N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]-2-(oxolan-3-yloxy)acetamide?

The InChIKey is VHCOSQCSLHJPIX-SMWLZWQYSA-N. The full InChI is InChI=1S/C25H33N3O4.2C24H29N3O3.C22H25N5O3.C22H30N4O5S.C21H26N4O4.C21H27N3O5S.C21H32N2O4.C20H24N2O3.C19H28N2O4.C18H26N2O4/c29-23(18-28-8-7-21-3-1-2-4-22(21)17-28)5-6-24(30)19-32-25-13-20(14-26-15-25)16-27-9-11-31-12-10-27;2*1-17-13-26(2)21-8-5-9-22(24(17)21)30-16-23(29)25-12-20(28)15-27-11-10-18-6-3-4-7-19(18)14-27;23-22-18-6-3-7-19(21(18)25-14-26-22)30-13-20(29)24-10-17(28)12-27-9-8-15-4-1-2-5-16(15)11-27;1-25(2)19-8-5-9-20(22(19)32(23,29)30)31-15-21(28)24-12-18(27)14-26-11-10-16-6-3-4-7-17(16)13-26;1-15(26)24-19-6-8-22-11-20(19)29-14-21(28)23-10-18(27)13-25-9-7-16-4-2-3-5-17(16)12-25;1-15(18(25)13-24-11-10-16-6-2-3-7-17(16)12-24)23-21(26)14-29-19-8-4-5-9-20(19)30(22,27)28;24-20(16-23-8-7-18-3-1-2-4-19(18)15-23)5-6-21(25)17-27-14-11-22-9-12-26-13-10-22;23-18(12-21-20(25)19(24)16-7-2-1-3-8-16)14-22-11-10-15-6-4-5-9-17(15)13-22;22-17(10-20-19(23)14-25-18-6-3-9-24-13-18)12-21-8-7-15-4-1-2-5-16(15)11-21;21-16(9-19-18(22)13-24-17-6-8-23-12-17)11-20-7-5-14-3-1-2-4-15(14)10-20/h1-4,13-15,23,29H,5-12,16-19H2;2*3-9,13,20,28H,10-12,14-16H2,1-2H3,(H,25,29);1-7,14,17,28H,8-13H2,(H,24,29)(H2,23,25,26);3-9,18,27H,10-15H2,1-2H3,(H,24,28)(H2,23,29,30);2-6,8,11,18,27H,7,9-10,12-14H2,1H3,(H,23,28)(H,22,24,26);2-9,15,18,25H,10-14H2,1H3,(H,23,26)(H2,22,27,28);1-4,20,24H,5-17H2;1-9,18-19,23-24H,10-14H2,(H,21,25);1-2,4-5,17-18,22H,3,6-14H2,(H,20,23);1-4,16-17,21H,5-13H2,(H,19,22)/t;2*20-;;;;;;;;/m.10......../s1.

What are the key properties of 2-[(4-acetamido-3-pyridinyl)oxy]-N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]acetamide;2-(4-aminoquinazolin-8-yl)oxy-N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]acetamide;N-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-hydroxybutan-2-yl]-2-(2-sulfamoylphenoxy)acetamide;6-(3,4-dihydro-1H-isoquinolin-2-yl)-5-hydroxy-1-(2-morpholin-4-ylethoxy)hexan-2-one;6-(3,4-dihydro-1H-isoquinolin-2-yl)-5-hydroxy-1-[[5-(morpholin-4-ylmethyl)-3-pyridinyl]oxy]hexan-2-one;N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]-2-[3-(dimethylamino)-2-sulfamoylphenoxy]acetamide;N-[(2S)-3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]-2-(1,3-dimethylindol-4-yl)oxyacetamide;N-[(2R)-3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]-2-(1,3-dimethylindol-4-yl)oxyacetamide;N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]-2-hydroxy-2-phenylacetamide;N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]-2-(oxan-3-yloxy)acetamide;N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]-2-(oxolan-3-yloxy)acetamide?

2-[(4-acetamido-3-pyridinyl)oxy]-N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]acetamide;2-(4-aminoquinazolin-8-yl)oxy-N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]acetamide;N-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-hydroxybutan-2-yl]-2-(2-sulfamoylphenoxy)acetamide;6-(3,4-dihydro-1H-isoquinolin-2-yl)-5-hydroxy-1-(2-morpholin-4-ylethoxy)hexan-2-one;6-(3,4-dihydro-1H-isoquinolin-2-yl)-5-hydroxy-1-[[5-(morpholin-4-ylmethyl)-3-pyridinyl]oxy]hexan-2-one;N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]-2-[3-(dimethylamino)-2-sulfamoylphenoxy]acetamide;N-[(2S)-3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]-2-(1,3-dimethylindol-4-yl)oxyacetamide;N-[(2R)-3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]-2-(1,3-dimethylindol-4-yl)oxyacetamide;N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]-2-hydroxy-2-phenylacetamide;N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]-2-(oxan-3-yloxy)acetamide;N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]-2-(oxolan-3-yloxy)acetamide has a molecular weight of 4356.40 g/mol, XLogP of 13.30, 86 rotatable bonds, 25 hydrogen bond donors, and 63 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[(4-acetamido-3-pyridinyl)oxy]-N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]acetamide;2-(4-aminoquinazolin-8-yl)oxy-N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]acetamide;N-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-hydroxybutan-2-yl]-2-(2-sulfamoylphenoxy)acetamide;6-(3,4-dihydro-1H-isoquinolin-2-yl)-5-hydroxy-1-(2-morpholin-4-ylethoxy)hexan-2-one;6-(3,4-dihydro-1H-isoquinolin-2-yl)-5-hydroxy-1-[[5-(morpholin-4-ylmethyl)-3-pyridinyl]oxy]hexan-2-one;N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]-2-[3-(dimethylamino)-2-sulfamoylphenoxy]acetamide;N-[(2S)-3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]-2-(1,3-dimethylindol-4-yl)oxyacetamide;N-[(2R)-3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]-2-(1,3-dimethylindol-4-yl)oxyacetamide;N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]-2-hydroxy-2-phenylacetamide;N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]-2-(oxan-3-yloxy)acetamide;N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]-2-(oxolan-3-yloxy)acetamide is sourced from PubChem (CID 161297074), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).