N-[3-[(1-acetylindol-3-yl)methylamino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;N-[3-[(2-hydroxy-4-methylphenyl)methylamino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;N-[3-[(2-hydroxyphenyl)methylamino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;N-[3-[(4-methylfuran-2-yl)methylamino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;N-[3-[(2-methylpyrimidin-4-yl)amino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;N-[3-[1,2-oxazol-4-ylmethyl(2H-pyrrol-4-ylmethyl)amino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;5-phenyl-N-[3-[(2-piperidin-1-ylpyrimidin-4-yl)amino]propyl]-1,2-oxazole-3-carboxamide;5-phenyl-N-[3-(2H-pyrrol-4-ylmethylamino)propyl]-1,2-oxazole-3-carboxamide

C164H177N33O21 — CID 158367875

IUPACN-[3-[(1-acetylindol-3-yl)methylamino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;N-[3-[(2-hydroxy-4-methylphenyl)methylamino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;N-[3-[(2-hydroxyphenyl)methylamino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;N-[3-[(4-methylfuran-2-yl)methylamino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;N-[3-[(2-methylpyrimidin-4-yl)amino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;N-[3-[1,2-oxazol-4-ylmethyl(2H-pyrrol-4-ylmethyl)amino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;5-phenyl-N-[3-[(2-piperidin-1-ylpyrimidin-4-yl)amino]propyl]-1,2-oxazole-3-carboxamide;5-phenyl-N-[3-(2H-pyrrol-4-ylmethylamino)propyl]-1,2-oxazole-3-carboxamide
SMILESCC(=O)n1cc(CNCCCNC(=O)c2cc(-c3ccccc3)on2)c2ccccc21.Cc1ccc(CNCCCNC(=O)c2cc(-c3ccccc3)on2)c(O)c1.Cc1coc(CNCCCNC(=O)c2cc(-c3ccccc3)on2)c1.Cc1nccc(NCCCNC(=O)c2cc(-c3ccccc3)on2)n1.O=C(NCCCN(CC1=CCN=C1)Cc1cnoc1)c1cc(-c2ccccc2)on1.O=C(NCCCNCC1=CCN=C1)c1cc(-c2ccccc2)on1.O=C(NCCCNCc1ccccc1O)c1cc(-c2ccccc2)on1.O=C(NCCCNc1ccnc(N2CCCCC2)n1)c1cc(-c2ccccc2)on1
InChIInChI=1S/C24H24N4O3.C22H26N6O2.C22H23N5O3.C21H23N3O3.C20H21N3O3.C19H21N3O3.C18H19N5O2.C18H20N4O2/c1-17(29)28-16-19(20-10-5-6-11-22(20)28)15-25-12-7-13-26-24(30)21-14-23(31-27-21)18-8-3-2-4-9-18;29-21(18-16-19(30-27-18)17-8-3-1-4-9-17)24-12-7-11-23-20-10-13-25-22(26-20)28-14-5-2-6-15-28;28-22(20-11-21(30-26-20)19-5-2-1-3-6-19)24-8-4-10-27(14-17-7-9-23-12-17)15-18-13-25-29-16-18;1-15-8-9-17(19(25)12-15)14-22-10-5-11-23-21(26)18-13-20(27-24-18)16-6-3-2-4-7-16;24-18-10-5-4-9-16(18)14-21-11-6-12-22-20(25)17-13-19(26-23-17)15-7-2-1-3-8-15;1-14-10-16(24-13-14)12-20-8-5-9-21-19(23)17-11-18(25-22-17)15-6-3-2-4-7-15;1-13-19-11-8-17(22-13)20-9-5-10-21-18(24)15-12-16(25-23-15)14-6-3-2-4-7-14;23-18(21-9-4-8-19-12-14-7-10-20-13-14)16-11-17(24-22-16)15-5-2-1-3-6-15/h2-6,8-11,14,16,25H,7,12-13,15H2,1H3,(H,26,30);1,3-4,8-10,13,16H,2,5-7,11-12,14-15H2,(H,24,29)(H,23,25,26);1-3,5-7,11-13,16H,4,8-10,14-15H2,(H,24,28);2-4,6-9,12-13,22,25H,5,10-11,14H2,1H3,(H,23,26);1-5,7-10,13,21,24H,6,11-12,14H2,(H,22,25);2-4,6-7,10-11,13,20H,5,8-9,12H2,1H3,(H,21,23);2-4,6-8,11-12H,5,9-10H2,1H3,(H,21,24)(H,19,20,22);1-3,5-7,11,13,19H,4,8-10,12H2,(H,21,23)
InChIKeyGUGFTPQEPHMVDV-UHFFFAOYSA-N
MW2946.43 g/mol
LogP24.29
Rot. Bonds65

About N-[3-[(1-acetylindol-3-yl)methylamino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;N-[3-[(2-hydroxy-4-methylphenyl)methylamino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;N-[3-[(2-hydroxyphenyl)methylamino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;N-[3-[(4-methylfuran-2-yl)methylamino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;N-[3-[(2-methylpyrimidin-4-yl)amino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;N-[3-[1,2-oxazol-4-ylmethyl(2H-pyrrol-4-ylmethyl)amino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;5-phenyl-N-[3-[(2-piperidin-1-ylpyrimidin-4-yl)amino]propyl]-1,2-oxazole-3-carboxamide;5-phenyl-N-[3-(2H-pyrrol-4-ylmethylamino)propyl]-1,2-oxazole-3-carboxamide

N-[3-[(1-acetylindol-3-yl)methylamino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;N-[3-[(2-hydroxy-4-methylphenyl)methylamino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;N-[3-[(2-hydroxyphenyl)methylamino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;N-[3-[(4-methylfuran-2-yl)methylamino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;N-[3-[(2-methylpyrimidin-4-yl)amino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;N-[3-[1,2-oxazol-4-ylmethyl(2H-pyrrol-4-ylmethyl)amino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;5-phenyl-N-[3-[(2-piperidin-1-ylpyrimidin-4-yl)amino]propyl]-1,2-oxazole-3-carboxamide;5-phenyl-N-[3-(2H-pyrrol-4-ylmethylamino)propyl]-1,2-oxazole-3-carboxamide (PubChem CID 158367875) has the molecular formula C164H177N33O21 and a molecular weight of 2946.43 g/mol. Its IUPAC name is N-[3-[(1-acetylindol-3-yl)methylamino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;N-[3-[(2-hydroxy-4-methylphenyl)methylamino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;N-[3-[(2-hydroxyphenyl)methylamino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;N-[3-[(4-methylfuran-2-yl)methylamino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;N-[3-[(2-methylpyrimidin-4-yl)amino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;N-[3-[1,2-oxazol-4-ylmethyl(2H-pyrrol-4-ylmethyl)amino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;5-phenyl-N-[3-[(2-piperidin-1-ylpyrimidin-4-yl)amino]propyl]-1,2-oxazole-3-carboxamide;5-phenyl-N-[3-(2H-pyrrol-4-ylmethylamino)propyl]-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound NameN-[3-[(1-acetylindol-3-yl)methylamino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;N-[3-[(2-hydroxy-4-methylphenyl)methylamino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;N-[3-[(2-hydroxyphenyl)methylamino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;N-[3-[(4-methylfuran-2-yl)methylamino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;N-[3-[(2-methylpyrimidin-4-yl)amino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;N-[3-[1,2-oxazol-4-ylmethyl(2H-pyrrol-4-ylmethyl)amino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;5-phenyl-N-[3-[(2-piperidin-1-ylpyrimidin-4-yl)amino]propyl]-1,2-oxazole-3-carboxamide;5-phenyl-N-[3-(2H-pyrrol-4-ylmethylamino)propyl]-1,2-oxazole-3-carboxamide
PubChem CID158367875
Molecular FormulaC164H177N33O21
Molecular Weight2946.43 g/mol
Exact Mass2944.38
IUPAC NameN-[3-[(1-acetylindol-3-yl)methylamino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;N-[3-[(2-hydroxy-4-methylphenyl)methylamino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;N-[3-[(2-hydroxyphenyl)methylamino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;N-[3-[(4-methylfuran-2-yl)methylamino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;N-[3-[(2-methylpyrimidin-4-yl)amino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;N-[3-[1,2-oxazol-4-ylmethyl(2H-pyrrol-4-ylmethyl)amino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;5-phenyl-N-[3-[(2-piperidin-1-ylpyrimidin-4-yl)amino]propyl]-1,2-oxazole-3-carboxamide;5-phenyl-N-[3-(2H-pyrrol-4-ylmethylamino)propyl]-1,2-oxazole-3-carboxamide
SMILESCC(=O)n1cc(CNCCCNC(=O)c2cc(-c3ccccc3)on2)c2ccccc21.Cc1ccc(CNCCCNC(=O)c2cc(-c3ccccc3)on2)c(O)c1.Cc1coc(CNCCCNC(=O)c2cc(-c3ccccc3)on2)c1.Cc1nccc(NCCCNC(=O)c2cc(-c3ccccc3)on2)n1.O=C(NCCCN(CC1=CCN=C1)Cc1cnoc1)c1cc(-c2ccccc2)on1.O=C(NCCCNCC1=CCN=C1)c1cc(-c2ccccc2)on1.O=C(NCCCNCc1ccccc1O)c1cc(-c2ccccc2)on1.O=C(NCCCNc1ccnc(N2CCCCC2)n1)c1cc(-c2ccccc2)on1
InChIInChI=1S/C24H24N4O3.C22H26N6O2.C22H23N5O3.C21H23N3O3.C20H21N3O3.C19H21N3O3.C18H19N5O2.C18H20N4O2/c1-17(29)28-16-19(20-10-5-6-11-22(20)28)15-25-12-7-13-26-24(30)21-14-23(31-27-21)18-8-3-2-4-9-18;29-21(18-16-19(30-27-18)17-8-3-1-4-9-17)24-12-7-11-23-20-10-13-25-22(26-20)28-14-5-2-6-15-28;28-22(20-11-21(30-26-20)19-5-2-1-3-6-19)24-8-4-10-27(14-17-7-9-23-12-17)15-18-13-25-29-16-18;1-15-8-9-17(19(25)12-15)14-22-10-5-11-23-21(26)18-13-20(27-24-18)16-6-3-2-4-7-16;24-18-10-5-4-9-16(18)14-21-11-6-12-22-20(25)17-13-19(26-23-17)15-7-2-1-3-8-15;1-14-10-16(24-13-14)12-20-8-5-9-21-19(23)17-11-18(25-22-17)15-6-3-2-4-7-15;1-13-19-11-8-17(22-13)20-9-5-10-21-18(24)15-12-16(25-23-15)14-6-3-2-4-7-14;23-18(21-9-4-8-19-12-14-7-10-20-13-14)16-11-17(24-22-16)15-5-2-1-3-6-15/h2-6,8-11,14,16,25H,7,12-13,15H2,1H3,(H,26,30);1,3-4,8-10,13,16H,2,5-7,11-12,14-15H2,(H,24,29)(H,23,25,26);1-3,5-7,11-13,16H,4,8-10,14-15H2,(H,24,28);2-4,6-9,12-13,22,25H,5,10-11,14H2,1H3,(H,23,26);1-5,7-10,13,21,24H,6,11-12,14H2,(H,22,25);2-4,6-7,10-11,13,20H,5,8-9,12H2,1H3,(H,21,23);2-4,6-8,11-12H,5,9-10H2,1H3,(H,21,24)(H,19,20,22);1-3,5-7,11,13,19H,4,8-10,12H2,(H,21,23)
InChIKeyGUGFTPQEPHMVDV-UHFFFAOYSA-N
XLogP24.29
TPSA709.64 Ų
H-Bond Donors17
H-Bond Acceptors46
Rotatable Bonds65
Heavy Atoms218
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002946.43
LogP ≤ 524.29
H-Bond Donors ≤ 517
H-Bond Acceptors ≤ 1046

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-phenyl-1,2-oxazole-3-carboxamide;N-[3-[(2-hydroxy-4-methylphenyl)methylamino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;N-[3-[(2-hydroxyphenyl)methylamino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;N-[3-[(4-methylfuran-2-yl)methylamino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;N-[3-[(2-methylpyrimidin-4-yl)amino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;N-[3-[1,2-oxazol-4-ylmethyl(2H-pyrrol-4-ylmethyl)amino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;5-phenyl-N-[3-[(2-piperidin-1-ylpyrimidin-4-yl)amino]propyl]-1,2-oxazole-3-carboxamide;5-phenyl-N-[3-(2H-pyrrol-4-ylmethylamino)propyl]-1,2-oxazole-3-carboxamide with MolForge

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Related Compounds

4-(7-amino-2-oxoheptoxy)-2-(2,6-dioxopiperidin-3-yl)isoindole-1,3-dione;2-[[2-[4-(3,5-dimethyl-1,2-oxazol-4-yl)phenyl]imidazo[1,2-a]pyrazin-3-yl]amino]acetic acid;3-[2-[4-(3,5-dimethyl-1,2-oxazol-4-yl)phenyl]imidazo[1,2-a]pyrazin-3-yl]-N-[7-[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindol-4-yl]oxy-6-oxoheptyl]propanamide;methane;2,2,2-trifluoroacetic acid
CID 159038589
4-(7-amino-2-oxoheptoxy)-2-(2,6-dioxopiperidin-3-yl)isoindole-1,3-dione;2-[[2-[4-(3,5-dimethyl-1,2-oxazol-4-yl)phenyl]imidazo[1,2-a]pyrazin-3-yl]amino]acetic acid;3-[2-[4-(3,5-dimethyl-1,2-oxazol-4-yl)phenyl]imidazo[1,2-a]pyrazin-3-yl]-N-[7-[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindol-4-yl]oxy-6-oxoheptyl]propanamide;methane;2,2,2-trifluoroacetic acid
CID 159372176
4-(7-amino-2-oxoheptoxy)-2-(2,6-dioxopiperidin-3-yl)isoindole-1,3-dione;2-[[2-[4-(3,5-dimethyl-1,2-oxazol-4-yl)phenyl]imidazo[1,2-a]pyrazin-3-yl]amino]acetic acid;3-[2-[4-(3,5-dimethyl-1,2-oxazol-4-yl)phenyl]imidazo[1,2-a]pyrazin-3-yl]-N-[7-[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindol-4-yl]oxy-6-oxoheptyl]propanamide;2,2,2-trifluoroacetic acid
CID 160528424
N-[3-[2-[2-(3-aminopropoxy)ethoxy]ethoxy]propyl]-2-[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindol-4-yl]oxyacetamide;2-[[2-[4-(3,5-dimethyl-1,2-oxazol-4-yl)phenyl]imidazo[1,2-a]pyrazin-3-yl]amino]acetic acid;N-[3-[2-[2-[6-[[2-[4-(3,5-dimethyl-1,2-oxazol-4-yl)phenyl]imidazo[1,2-a]pyrazin-3-yl]amino]-5-oxohexoxy]ethoxy]ethoxy]propyl]-2-[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindol-4-yl]oxyacetamide;2,2,2-trifluoroacetic acid
CID 165040652
N-(4-aminobutyl)-2-[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindol-4-yl]oxyacetamide;2-[[2-[4-(3,5-dimethyl-1,2-oxazol-4-yl)phenyl]imidazo[1,2-a]pyrazin-3-yl]amino]acetic acid;2-[[2-[4-(3,5-dimethyl-1,2-oxazol-4-yl)phenyl]imidazo[1,2-a]pyrazin-3-yl]amino]-N-[4-[[2-[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindol-4-yl]oxyacetyl]amino]butyl]acetamide;2,2,2-trifluoroacetic acid
CID 165104808
N-[3-[2-[2-[2-[2-[2-[2-[2-[2-[4-[7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-methoxy-1-[(2R)-1-methoxypropan-2-yl]imidazo[4,5-c]quinolin-2-yl]piperidin-1-yl]-2-oxoethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethylamino]-3-oxopropyl]-1-methyl-4-[3-[[1-methyl-4-[[1-methyl-4-[3-[[1-methyl-4-[(1-methylimidazole-2-carbonyl)amino]pyrrole-2-carbonyl]amino]propanoylamino]imidazole-2-carbonyl]amino]pyrrole-2-carbonyl]amino]propanoylamino]imidazole-2-carboxamide
CID 168737120
N-[3-[3-[3-[3-[2-[2-[2-[2-[2-[4-[7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-methoxy-1-[(2R)-1-methoxypropan-2-yl]imidazo[4,5-c]quinolin-2-yl]piperidin-1-yl]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propanoylamino]propyl-methylamino]propylamino]-3-oxopropyl]-1-methyl-4-[3-[[1-methyl-4-[[1-methyl-4-[3-[[1-methyl-4-[(1-methylimidazole-2-carbonyl)amino]pyrrole-2-carbonyl]amino]propanoylamino]imidazole-2-carbonyl]amino]pyrrole-2-carbonyl]amino]propanoylamino]imidazole-2-carboxamide
CID 168737255
N-[3-[2-[2-[2-[2-[2-[2-[2-[2-[2-[4-[7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-methoxy-1-[(2R)-1-methoxypropan-2-yl]imidazo[4,5-c]quinolin-2-yl]piperidin-1-yl]-2-oxoethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethylamino]-3-oxopropyl]-1-methyl-4-[3-[[1-methyl-4-[[1-methyl-4-[3-[[1-methyl-4-[(1-methylimidazole-2-carbonyl)amino]pyrrole-2-carbonyl]amino]propanoylamino]imidazole-2-carbonyl]amino]pyrrole-2-carbonyl]amino]propanoylamino]imidazole-2-carboxamide
CID 168737262
N-[3-[3-[3-[3-[2-[2-[2-[2-[2-[4-[7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-methoxy-1-[(2R)-1-methoxypropan-2-yl]imidazo[4,5-c]quinolin-2-yl]piperidin-1-yl]-2-oxoethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propanoylamino]propyl-methylamino]propylamino]-3-oxopropyl]-1-methyl-4-[3-[[1-methyl-4-[[1-methyl-4-[3-[[1-methyl-4-[(1-methylimidazole-2-carbonyl)amino]pyrrole-2-carbonyl]amino]propanoylamino]imidazole-2-carbonyl]amino]pyrrole-2-carbonyl]amino]propanoylamino]imidazole-2-carboxamide
CID 168737267
4-[8-amino-1-(1-benzofuran-2-yl)-5-methylimidazo[1,5-a]pyrazin-3-yl]cyclohexane-1-carboxamide;4-[8-amino-5-ethyl-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]cyclohexane-1-carboxylic acid;4-[8-amino-1-(7-oxo-1,6-dihydropyrrolo[2,3-c]pyridin-2-yl)imidazo[1,5-a]pyrazin-3-yl]cyclohexane-1-carboxylic acid;N-[[4-[8-amino-1-(1H-pyrrolo[2,3-b]pyridin-2-yl)imidazo[1,5-a]pyrazin-3-yl]cyclohexyl]methyl]acetamide;N-[[4-[8-amino-1-(1H-pyrrolo[3,2-b]pyridin-2-yl)imidazo[1,5-a]pyrazin-3-yl]cyclohexyl]methyl]acetamide
CID 90701143
4-[8-amino-1-(1-benzofuran-2-yl)-5-methylimidazo[1,5-a]pyrazin-3-yl]cyclohexane-1-carboxamide;N-[[4-[8-amino-1-(1H-pyrrolo[2,3-b]pyridin-2-yl)imidazo[1,5-a]pyrazin-3-yl]cyclohexyl]methyl]acetamide;N-[[4-[8-amino-1-(1H-pyrrolo[3,2-b]pyridin-2-yl)imidazo[1,5-a]pyrazin-3-yl]cyclohexyl]methyl]acetamide
CID 91465518
7-(3,5-dimethyl-1,2-oxazol-4-yl)-6-methoxy-N-(2-morpholin-4-ylethyl)-4-quinolin-4-yl-9H-pyrimido[4,5-b]indole-2-carboxamide
CID 117636881

Frequently Asked Questions

What is the IUPAC name of N-[3-[(1-acetylindol-3-yl)methylamino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;N-[3-[(2-hydroxy-4-methylphenyl)methylamino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;N-[3-[(2-hydroxyphenyl)methylamino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;N-[3-[(4-methylfuran-2-yl)methylamino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;N-[3-[(2-methylpyrimidin-4-yl)amino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;N-[3-[1,2-oxazol-4-ylmethyl(2H-pyrrol-4-ylmethyl)amino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;5-phenyl-N-[3-[(2-piperidin-1-ylpyrimidin-4-yl)amino]propyl]-1,2-oxazole-3-carboxamide;5-phenyl-N-[3-(2H-pyrrol-4-ylmethylamino)propyl]-1,2-oxazole-3-carboxamide?
The IUPAC name of N-[3-[(1-acetylindol-3-yl)methylamino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;N-[3-[(2-hydroxy-4-methylphenyl)methylamino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;N-[3-[(2-hydroxyphenyl)methylamino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;N-[3-[(4-methylfuran-2-yl)methylamino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;N-[3-[(2-methylpyrimidin-4-yl)amino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;N-[3-[1,2-oxazol-4-ylmethyl(2H-pyrrol-4-ylmethyl)amino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;5-phenyl-N-[3-[(2-piperidin-1-ylpyrimidin-4-yl)amino]propyl]-1,2-oxazole-3-carboxamide;5-phenyl-N-[3-(2H-pyrrol-4-ylmethylamino)propyl]-1,2-oxazole-3-carboxamide (CID 158367875) is N-[3-[(1-acetylindol-3-yl)methylamino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;N-[3-[(2-hydroxy-4-methylphenyl)methylamino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;N-[3-[(2-hydroxyphenyl)methylamino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;N-[3-[(4-methylfuran-2-yl)methylamino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;N-[3-[(2-methylpyrimidin-4-yl)amino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;N-[3-[1,2-oxazol-4-ylmethyl(2H-pyrrol-4-ylmethyl)amino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;5-phenyl-N-[3-[(2-piperidin-1-ylpyrimidin-4-yl)amino]propyl]-1,2-oxazole-3-carboxamide;5-phenyl-N-[3-(2H-pyrrol-4-ylmethylamino)propyl]-1,2-oxazole-3-carboxamide.
What is the SMILES notation for N-[3-[(1-acetylindol-3-yl)methylamino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;N-[3-[(2-hydroxy-4-methylphenyl)methylamino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;N-[3-[(2-hydroxyphenyl)methylamino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;N-[3-[(4-methylfuran-2-yl)methylamino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;N-[3-[(2-methylpyrimidin-4-yl)amino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;N-[3-[1,2-oxazol-4-ylmethyl(2H-pyrrol-4-ylmethyl)amino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;5-phenyl-N-[3-[(2-piperidin-1-ylpyrimidin-4-yl)amino]propyl]-1,2-oxazole-3-carboxamide;5-phenyl-N-[3-(2H-pyrrol-4-ylmethylamino)propyl]-1,2-oxazole-3-carboxamide?
The canonical SMILES for N-[3-[(1-acetylindol-3-yl)methylamino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;N-[3-[(2-hydroxy-4-methylphenyl)methylamino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;N-[3-[(2-hydroxyphenyl)methylamino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;N-[3-[(4-methylfuran-2-yl)methylamino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;N-[3-[(2-methylpyrimidin-4-yl)amino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;N-[3-[1,2-oxazol-4-ylmethyl(2H-pyrrol-4-ylmethyl)amino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;5-phenyl-N-[3-[(2-piperidin-1-ylpyrimidin-4-yl)amino]propyl]-1,2-oxazole-3-carboxamide;5-phenyl-N-[3-(2H-pyrrol-4-ylmethylamino)propyl]-1,2-oxazole-3-carboxamide is CC(=O)n1cc(CNCCCNC(=O)c2cc(-c3ccccc3)on2)c2ccccc21.Cc1ccc(CNCCCNC(=O)c2cc(-c3ccccc3)on2)c(O)c1.Cc1coc(CNCCCNC(=O)c2cc(-c3ccccc3)on2)c1.Cc1nccc(NCCCNC(=O)c2cc(-c3ccccc3)on2)n1.O=C(NCCCN(CC1=CCN=C1)Cc1cnoc1)c1cc(-c2ccccc2)on1.O=C(NCCCNCC1=CCN=C1)c1cc(-c2ccccc2)on1.O=C(NCCCNCc1ccccc1O)c1cc(-c2ccccc2)on1.O=C(NCCCNc1ccnc(N2CCCCC2)n1)c1cc(-c2ccccc2)on1.
What is the InChIKey of N-[3-[(1-acetylindol-3-yl)methylamino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;N-[3-[(2-hydroxy-4-methylphenyl)methylamino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;N-[3-[(2-hydroxyphenyl)methylamino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;N-[3-[(4-methylfuran-2-yl)methylamino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;N-[3-[(2-methylpyrimidin-4-yl)amino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;N-[3-[1,2-oxazol-4-ylmethyl(2H-pyrrol-4-ylmethyl)amino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;5-phenyl-N-[3-[(2-piperidin-1-ylpyrimidin-4-yl)amino]propyl]-1,2-oxazole-3-carboxamide;5-phenyl-N-[3-(2H-pyrrol-4-ylmethylamino)propyl]-1,2-oxazole-3-carboxamide?
The InChIKey is GUGFTPQEPHMVDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24N4O3.C22H26N6O2.C22H23N5O3.C21H23N3O3.C20H21N3O3.C19H21N3O3.C18H19N5O2.C18H20N4O2/c1-17(29)28-16-19(20-10-5-6-11-22(20)28)15-25-12-7-13-26-24(30)21-14-23(31-27-21)18-8-3-2-4-9-18;29-21(18-16-19(30-27-18)17-8-3-1-4-9-17)24-12-7-11-23-20-10-13-25-22(26-20)28-14-5-2-6-15-28;28-22(20-11-21(30-26-20)19-5-2-1-3-6-19)24-8-4-10-27(14-17-7-9-23-12-17)15-18-13-25-29-16-18;1-15-8-9-17(19(25)12-15)14-22-10-5-11-23-21(26)18-13-20(27-24-18)16-6-3-2-4-7-16;24-18-10-5-4-9-16(18)14-21-11-6-12-22-20(25)17-13-19(26-23-17)15-7-2-1-3-8-15;1-14-10-16(24-13-14)12-20-8-5-9-21-19(23)17-11-18(25-22-17)15-6-3-2-4-7-15;1-13-19-11-8-17(22-13)20-9-5-10-21-18(24)15-12-16(25-23-15)14-6-3-2-4-7-14;23-18(21-9-4-8-19-12-14-7-10-20-13-14)16-11-17(24-22-16)15-5-2-1-3-6-15/h2-6,8-11,14,16,25H,7,12-13,15H2,1H3,(H,26,30);1,3-4,8-10,13,16H,2,5-7,11-12,14-15H2,(H,24,29)(H,23,25,26);1-3,5-7,11-13,16H,4,8-10,14-15H2,(H,24,28);2-4,6-9,12-13,22,25H,5,10-11,14H2,1H3,(H,23,26);1-5,7-10,13,21,24H,6,11-12,14H2,(H,22,25);2-4,6-7,10-11,13,20H,5,8-9,12H2,1H3,(H,21,23);2-4,6-8,11-12H,5,9-10H2,1H3,(H,21,24)(H,19,20,22);1-3,5-7,11,13,19H,4,8-10,12H2,(H,21,23).
What are the key properties of N-[3-[(1-acetylindol-3-yl)methylamino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;N-[3-[(2-hydroxy-4-methylphenyl)methylamino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;N-[3-[(2-hydroxyphenyl)methylamino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;N-[3-[(4-methylfuran-2-yl)methylamino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;N-[3-[(2-methylpyrimidin-4-yl)amino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;N-[3-[1,2-oxazol-4-ylmethyl(2H-pyrrol-4-ylmethyl)amino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;5-phenyl-N-[3-[(2-piperidin-1-ylpyrimidin-4-yl)amino]propyl]-1,2-oxazole-3-carboxamide;5-phenyl-N-[3-(2H-pyrrol-4-ylmethylamino)propyl]-1,2-oxazole-3-carboxamide?
N-[3-[(1-acetylindol-3-yl)methylamino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;N-[3-[(2-hydroxy-4-methylphenyl)methylamino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;N-[3-[(2-hydroxyphenyl)methylamino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;N-[3-[(4-methylfuran-2-yl)methylamino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;N-[3-[(2-methylpyrimidin-4-yl)amino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;N-[3-[1,2-oxazol-4-ylmethyl(2H-pyrrol-4-ylmethyl)amino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;5-phenyl-N-[3-[(2-piperidin-1-ylpyrimidin-4-yl)amino]propyl]-1,2-oxazole-3-carboxamide;5-phenyl-N-[3-(2H-pyrrol-4-ylmethylamino)propyl]-1,2-oxazole-3-carboxamide has a molecular weight of 2946.43 g/mol, XLogP of 24.29, 65 rotatable bonds, 17 hydrogen bond donors, and 46 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[(1-acetylindol-3-yl)methylamino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;N-[3-[(2-hydroxy-4-methylphenyl)methylamino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;N-[3-[(2-hydroxyphenyl)methylamino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;N-[3-[(4-methylfuran-2-yl)methylamino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;N-[3-[(2-methylpyrimidin-4-yl)amino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;N-[3-[1,2-oxazol-4-ylmethyl(2H-pyrrol-4-ylmethyl)amino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;5-phenyl-N-[3-[(2-piperidin-1-ylpyrimidin-4-yl)amino]propyl]-1,2-oxazole-3-carboxamide;5-phenyl-N-[3-(2H-pyrrol-4-ylmethylamino)propyl]-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 158367875), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).