N-[3-[(5-ethylfuran-2-carbonyl)amino]propyl]-5-thiophen-2-yl-1,2-oxazole-3-carboxamide;N-[3-[[2-(1H-indol-3-yl)acetyl]amino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;N-[3-[(5-methylfuran-2-carbonyl)amino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;bis(N-[3-[(6-methylpyrazine-2-carbonyl)amino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide);N-[3-[(6-methylpyrazine-2-carbonyl)amino]propyl]-5-thiophen-2-yl-1,2-oxazole-3-carboxamide;N-[3-[(6-methylpyridine-2-carbonyl)amino]propyl]-5-thiophen-2-yl-1,2-oxazole-3-carboxamide;N-[3-(oxane-2-carbonylamino)propyl]-5-thiophen-2-yl-1,2-oxazole-3-carboxamide;5-phenyl-N-[3-[(3-phenylfuran-2-carbonyl)amino]propyl]-1,2-oxazole-3-carboxamide;5-phenyl-N-[3-[(4-phenylpyridine-2-carbonyl)amino]propyl]-1,2-oxazole-3-carboxamide

C199H197N39O34S4 — CID 158084713

IUPACN-[3-[(5-ethylfuran-2-carbonyl)amino]propyl]-5-thiophen-2-yl-1,2-oxazole-3-carboxamide;N-[3-[[2-(1H-indol-3-yl)acetyl]amino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;N-[3-[(5-methylfuran-2-carbonyl)amino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;bis(N-[3-[(6-methylpyrazine-2-carbonyl)amino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide);N-[3-[(6-methylpyrazine-2-carbonyl)amino]propyl]-5-thiophen-2-yl-1,2-oxazole-3-carboxamide;N-[3-[(6-methylpyridine-2-carbonyl)amino]propyl]-5-thiophen-2-yl-1,2-oxazole-3-carboxamide;N-[3-(oxane-2-carbonylamino)propyl]-5-thiophen-2-yl-1,2-oxazole-3-carboxamide;5-phenyl-N-[3-[(3-phenylfuran-2-carbonyl)amino]propyl]-1,2-oxazole-3-carboxamide;5-phenyl-N-[3-[(4-phenylpyridine-2-carbonyl)amino]propyl]-1,2-oxazole-3-carboxamide
SMILESCCc1ccc(C(=O)NCCCNC(=O)c2cc(-c3cccs3)on2)o1.Cc1ccc(C(=O)NCCCNC(=O)c2cc(-c3ccccc3)on2)o1.Cc1cccc(C(=O)NCCCNC(=O)c2cc(-c3cccs3)on2)n1.Cc1cncc(C(=O)NCCCNC(=O)c2cc(-c3ccccc3)on2)n1.Cc1cncc(C(=O)NCCCNC(=O)c2cc(-c3ccccc3)on2)n1.Cc1cncc(C(=O)NCCCNC(=O)c2cc(-c3cccs3)on2)n1.O=C(Cc1c[nH]c2ccccc12)NCCCNC(=O)c1cc(-c2ccccc2)on1.O=C(NCCCNC(=O)C1CCCCO1)c1cc(-c2cccs2)on1.O=C(NCCCNC(=O)c1cc(-c2ccccc2)on1)c1cc(-c2ccccc2)ccn1.O=C(NCCCNC(=O)c1occc1-c1ccccc1)c1cc(-c2ccccc2)on1
InChIInChI=1S/C25H22N4O3.C24H21N3O4.C23H22N4O3.2C19H19N5O3.C19H19N3O4.C18H18N4O3S.C18H19N3O4S.C17H17N5O3S.C17H21N3O4S/c30-24(21-16-20(12-15-26-21)18-8-3-1-4-9-18)27-13-7-14-28-25(31)22-17-23(32-29-22)19-10-5-2-6-11-19;28-23(20-16-21(31-27-20)18-10-5-2-6-11-18)25-13-7-14-26-24(29)22-19(12-15-30-22)17-8-3-1-4-9-17;28-22(13-17-15-26-19-10-5-4-9-18(17)19)24-11-6-12-25-23(29)20-14-21(30-27-20)16-7-2-1-3-8-16;2*1-13-11-20-12-16(23-13)19(26)22-9-5-8-21-18(25)15-10-17(27-24-15)14-6-3-2-4-7-14;1-13-8-9-16(25-13)19(24)21-11-5-10-20-18(23)15-12-17(26-22-15)14-6-3-2-4-7-14;1-12-5-2-6-13(21-12)17(23)19-8-4-9-20-18(24)14-11-15(25-22-14)16-7-3-10-26-16;1-2-12-6-7-14(24-12)18(23)20-9-4-8-19-17(22)13-11-15(25-21-13)16-5-3-10-26-16;1-11-9-18-10-13(21-11)17(24)20-6-3-5-19-16(23)12-8-14(25-22-12)15-4-2-7-26-15;21-16(12-11-14(24-20-12)15-6-3-10-25-15)18-7-4-8-19-17(22)13-5-1-2-9-23-13/h1-6,8-12,15-17H,7,13-14H2,(H,27,30)(H,28,31);1-6,8-12,15-16H,7,13-14H2,(H,25,28)(H,26,29);1-5,7-10,14-15,26H,6,11-13H2,(H,24,28)(H,25,29);2*2-4,6-7,10-12H,5,8-9H2,1H3,(H,21,25)(H,22,26);2-4,6-9,12H,5,10-11H2,1H3,(H,20,23)(H,21,24);2-3,5-7,10-11H,4,8-9H2,1H3,(H,19,23)(H,20,24);3,5-7,10-11H,2,4,8-9H2,1H3,(H,19,22)(H,20,23);2,4,7-10H,3,5-6H2,1H3,(H,19,23)(H,20,24);3,6,10-11,13H,1-2,4-5,7-9H2,(H,18,21)(H,19,22)
InChIKeyFNJHSAHDGBZLHV-UHFFFAOYSA-N
MW3807.27 g/mol
LogP28.20
Rot. Bonds74

About N-[3-[(5-ethylfuran-2-carbonyl)amino]propyl]-5-thiophen-2-yl-1,2-oxazole-3-carboxamide;N-[3-[[2-(1H-indol-3-yl)acetyl]amino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;N-[3-[(5-methylfuran-2-carbonyl)amino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;bis(N-[3-[(6-methylpyrazine-2-carbonyl)amino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide);N-[3-[(6-methylpyrazine-2-carbonyl)amino]propyl]-5-thiophen-2-yl-1,2-oxazole-3-carboxamide;N-[3-[(6-methylpyridine-2-carbonyl)amino]propyl]-5-thiophen-2-yl-1,2-oxazole-3-carboxamide;N-[3-(oxane-2-carbonylamino)propyl]-5-thiophen-2-yl-1,2-oxazole-3-carboxamide;5-phenyl-N-[3-[(3-phenylfuran-2-carbonyl)amino]propyl]-1,2-oxazole-3-carboxamide;5-phenyl-N-[3-[(4-phenylpyridine-2-carbonyl)amino]propyl]-1,2-oxazole-3-carboxamide

N-[3-[(5-ethylfuran-2-carbonyl)amino]propyl]-5-thiophen-2-yl-1,2-oxazole-3-carboxamide;N-[3-[[2-(1H-indol-3-yl)acetyl]amino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;N-[3-[(5-methylfuran-2-carbonyl)amino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;bis(N-[3-[(6-methylpyrazine-2-carbonyl)amino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide);N-[3-[(6-methylpyrazine-2-carbonyl)amino]propyl]-5-thiophen-2-yl-1,2-oxazole-3-carboxamide;N-[3-[(6-methylpyridine-2-carbonyl)amino]propyl]-5-thiophen-2-yl-1,2-oxazole-3-carboxamide;N-[3-(oxane-2-carbonylamino)propyl]-5-thiophen-2-yl-1,2-oxazole-3-carboxamide;5-phenyl-N-[3-[(3-phenylfuran-2-carbonyl)amino]propyl]-1,2-oxazole-3-carboxamide;5-phenyl-N-[3-[(4-phenylpyridine-2-carbonyl)amino]propyl]-1,2-oxazole-3-carboxamide (PubChem CID 158084713) has the molecular formula C199H197N39O34S4 and a molecular weight of 3807.27 g/mol. Its IUPAC name is N-[3-[(5-ethylfuran-2-carbonyl)amino]propyl]-5-thiophen-2-yl-1,2-oxazole-3-carboxamide;N-[3-[[2-(1H-indol-3-yl)acetyl]amino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;N-[3-[(5-methylfuran-2-carbonyl)amino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;bis(N-[3-[(6-methylpyrazine-2-carbonyl)amino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide);N-[3-[(6-methylpyrazine-2-carbonyl)amino]propyl]-5-thiophen-2-yl-1,2-oxazole-3-carboxamide;N-[3-[(6-methylpyridine-2-carbonyl)amino]propyl]-5-thiophen-2-yl-1,2-oxazole-3-carboxamide;N-[3-(oxane-2-carbonylamino)propyl]-5-thiophen-2-yl-1,2-oxazole-3-carboxamide;5-phenyl-N-[3-[(3-phenylfuran-2-carbonyl)amino]propyl]-1,2-oxazole-3-carboxamide;5-phenyl-N-[3-[(4-phenylpyridine-2-carbonyl)amino]propyl]-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound NameN-[3-[(5-ethylfuran-2-carbonyl)amino]propyl]-5-thiophen-2-yl-1,2-oxazole-3-carboxamide;N-[3-[[2-(1H-indol-3-yl)acetyl]amino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;N-[3-[(5-methylfuran-2-carbonyl)amino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;bis(N-[3-[(6-methylpyrazine-2-carbonyl)amino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide);N-[3-[(6-methylpyrazine-2-carbonyl)amino]propyl]-5-thiophen-2-yl-1,2-oxazole-3-carboxamide;N-[3-[(6-methylpyridine-2-carbonyl)amino]propyl]-5-thiophen-2-yl-1,2-oxazole-3-carboxamide;N-[3-(oxane-2-carbonylamino)propyl]-5-thiophen-2-yl-1,2-oxazole-3-carboxamide;5-phenyl-N-[3-[(3-phenylfuran-2-carbonyl)amino]propyl]-1,2-oxazole-3-carboxamide;5-phenyl-N-[3-[(4-phenylpyridine-2-carbonyl)amino]propyl]-1,2-oxazole-3-carboxamide
PubChem CID158084713
Molecular FormulaC199H197N39O34S4
Molecular Weight3807.27 g/mol
Exact Mass3804.38
IUPAC NameN-[3-[(5-ethylfuran-2-carbonyl)amino]propyl]-5-thiophen-2-yl-1,2-oxazole-3-carboxamide;N-[3-[[2-(1H-indol-3-yl)acetyl]amino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;N-[3-[(5-methylfuran-2-carbonyl)amino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;bis(N-[3-[(6-methylpyrazine-2-carbonyl)amino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide);N-[3-[(6-methylpyrazine-2-carbonyl)amino]propyl]-5-thiophen-2-yl-1,2-oxazole-3-carboxamide;N-[3-[(6-methylpyridine-2-carbonyl)amino]propyl]-5-thiophen-2-yl-1,2-oxazole-3-carboxamide;N-[3-(oxane-2-carbonylamino)propyl]-5-thiophen-2-yl-1,2-oxazole-3-carboxamide;5-phenyl-N-[3-[(3-phenylfuran-2-carbonyl)amino]propyl]-1,2-oxazole-3-carboxamide;5-phenyl-N-[3-[(4-phenylpyridine-2-carbonyl)amino]propyl]-1,2-oxazole-3-carboxamide
SMILESCCc1ccc(C(=O)NCCCNC(=O)c2cc(-c3cccs3)on2)o1.Cc1ccc(C(=O)NCCCNC(=O)c2cc(-c3ccccc3)on2)o1.Cc1cccc(C(=O)NCCCNC(=O)c2cc(-c3cccs3)on2)n1.Cc1cncc(C(=O)NCCCNC(=O)c2cc(-c3ccccc3)on2)n1.Cc1cncc(C(=O)NCCCNC(=O)c2cc(-c3ccccc3)on2)n1.Cc1cncc(C(=O)NCCCNC(=O)c2cc(-c3cccs3)on2)n1.O=C(Cc1c[nH]c2ccccc12)NCCCNC(=O)c1cc(-c2ccccc2)on1.O=C(NCCCNC(=O)C1CCCCO1)c1cc(-c2cccs2)on1.O=C(NCCCNC(=O)c1cc(-c2ccccc2)on1)c1cc(-c2ccccc2)ccn1.O=C(NCCCNC(=O)c1occc1-c1ccccc1)c1cc(-c2ccccc2)on1
InChIInChI=1S/C25H22N4O3.C24H21N3O4.C23H22N4O3.2C19H19N5O3.C19H19N3O4.C18H18N4O3S.C18H19N3O4S.C17H17N5O3S.C17H21N3O4S/c30-24(21-16-20(12-15-26-21)18-8-3-1-4-9-18)27-13-7-14-28-25(31)22-17-23(32-29-22)19-10-5-2-6-11-19;28-23(20-16-21(31-27-20)18-10-5-2-6-11-18)25-13-7-14-26-24(29)22-19(12-15-30-22)17-8-3-1-4-9-17;28-22(13-17-15-26-19-10-5-4-9-18(17)19)24-11-6-12-25-23(29)20-14-21(30-27-20)16-7-2-1-3-8-16;2*1-13-11-20-12-16(23-13)19(26)22-9-5-8-21-18(25)15-10-17(27-24-15)14-6-3-2-4-7-14;1-13-8-9-16(25-13)19(24)21-11-5-10-20-18(23)15-12-17(26-22-15)14-6-3-2-4-7-14;1-12-5-2-6-13(21-12)17(23)19-8-4-9-20-18(24)14-11-15(25-22-14)16-7-3-10-26-16;1-2-12-6-7-14(24-12)18(23)20-9-4-8-19-17(22)13-11-15(25-21-13)16-5-3-10-26-16;1-11-9-18-10-13(21-11)17(24)20-6-3-5-19-16(23)12-8-14(25-22-12)15-4-2-7-26-15;21-16(12-11-14(24-20-12)15-6-3-10-25-15)18-7-4-8-19-17(22)13-5-1-2-9-23-13/h1-6,8-12,15-17H,7,13-14H2,(H,27,30)(H,28,31);1-6,8-12,15-16H,7,13-14H2,(H,25,28)(H,26,29);1-5,7-10,14-15,26H,6,11-13H2,(H,24,28)(H,25,29);2*2-4,6-7,10-12H,5,8-9H2,1H3,(H,21,25)(H,22,26);2-4,6-9,12H,5,10-11H2,1H3,(H,20,23)(H,21,24);2-3,5-7,10-11H,4,8-9H2,1H3,(H,19,23)(H,20,24);3,5-7,10-11H,2,4,8-9H2,1H3,(H,19,22)(H,20,23);2,4,7-10H,3,5-6H2,1H3,(H,19,23)(H,20,24);3,6,10-11,13H,1-2,4-5,7-9H2,(H,18,21)(H,19,22)
InChIKeyFNJHSAHDGBZLHV-UHFFFAOYSA-N
XLogP28.20
TPSA1009.86 Ų
H-Bond Donors21
H-Bond Acceptors56
Rotatable Bonds74
Heavy Atoms276
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003807.27
LogP ≤ 528.20
H-Bond Donors ≤ 521
H-Bond Acceptors ≤ 1056

Computed Properties (RDKit)

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

Analyze N-[3-[(5-ethylfuran-2-carbonyl)amino]propyl]-5-thiophen-2-yl-1,2-oxazole-3-carboxamide;N-[3-[[2-(1H-indol-3-yl)acetyl]amino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;N-[3-[(5-methylfuran-2-carbonyl)amino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;bis(N-[3-[(6-methylpyrazine-2-carbonyl)amino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide);N-[3-[(6-methylpyrazine-2-carbonyl)amino]propyl]-5-thiophen-2-yl-1,2-oxazole-3-carboxamide;N-[3-[(6-methylpyridine-2-carbonyl)amino]propyl]-5-thiophen-2-yl-1,2-oxazole-3-carboxamide;N-[3-(oxane-2-carbonylamino)propyl]-5-thiophen-2-yl-1,2-oxazole-3-carboxamide;5-phenyl-N-[3-[(3-phenylfuran-2-carbonyl)amino]propyl]-1,2-oxazole-3-carboxamide;5-phenyl-N-[3-[(4-phenylpyridine-2-carbonyl)amino]propyl]-1,2-oxazole-3-carboxamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-[3-[(5-ethylfuran-2-carbonyl)amino]propyl]-5-thiophen-2-yl-1,2-oxazole-3-carboxamide;N-[3-[[2-(1H-indol-3-yl)acetyl]amino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;N-[3-[(5-methylfuran-2-carbonyl)amino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;bis(N-[3-[(6-methylpyrazine-2-carbonyl)amino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide);N-[3-[(6-methylpyrazine-2-carbonyl)amino]propyl]-5-thiophen-2-yl-1,2-oxazole-3-carboxamide;N-[3-[(6-methylpyridine-2-carbonyl)amino]propyl]-5-thiophen-2-yl-1,2-oxazole-3-carboxamide;N-[3-(oxane-2-carbonylamino)propyl]-5-thiophen-2-yl-1,2-oxazole-3-carboxamide;5-phenyl-N-[3-[(3-phenylfuran-2-carbonyl)amino]propyl]-1,2-oxazole-3-carboxamide;5-phenyl-N-[3-[(4-phenylpyridine-2-carbonyl)amino]propyl]-1,2-oxazole-3-carboxamide?
The IUPAC name of N-[3-[(5-ethylfuran-2-carbonyl)amino]propyl]-5-thiophen-2-yl-1,2-oxazole-3-carboxamide;N-[3-[[2-(1H-indol-3-yl)acetyl]amino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;N-[3-[(5-methylfuran-2-carbonyl)amino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;bis(N-[3-[(6-methylpyrazine-2-carbonyl)amino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide);N-[3-[(6-methylpyrazine-2-carbonyl)amino]propyl]-5-thiophen-2-yl-1,2-oxazole-3-carboxamide;N-[3-[(6-methylpyridine-2-carbonyl)amino]propyl]-5-thiophen-2-yl-1,2-oxazole-3-carboxamide;N-[3-(oxane-2-carbonylamino)propyl]-5-thiophen-2-yl-1,2-oxazole-3-carboxamide;5-phenyl-N-[3-[(3-phenylfuran-2-carbonyl)amino]propyl]-1,2-oxazole-3-carboxamide;5-phenyl-N-[3-[(4-phenylpyridine-2-carbonyl)amino]propyl]-1,2-oxazole-3-carboxamide (CID 158084713) is N-[3-[(5-ethylfuran-2-carbonyl)amino]propyl]-5-thiophen-2-yl-1,2-oxazole-3-carboxamide;N-[3-[[2-(1H-indol-3-yl)acetyl]amino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;N-[3-[(5-methylfuran-2-carbonyl)amino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;bis(N-[3-[(6-methylpyrazine-2-carbonyl)amino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide);N-[3-[(6-methylpyrazine-2-carbonyl)amino]propyl]-5-thiophen-2-yl-1,2-oxazole-3-carboxamide;N-[3-[(6-methylpyridine-2-carbonyl)amino]propyl]-5-thiophen-2-yl-1,2-oxazole-3-carboxamide;N-[3-(oxane-2-carbonylamino)propyl]-5-thiophen-2-yl-1,2-oxazole-3-carboxamide;5-phenyl-N-[3-[(3-phenylfuran-2-carbonyl)amino]propyl]-1,2-oxazole-3-carboxamide;5-phenyl-N-[3-[(4-phenylpyridine-2-carbonyl)amino]propyl]-1,2-oxazole-3-carboxamide.
What is the SMILES notation for N-[3-[(5-ethylfuran-2-carbonyl)amino]propyl]-5-thiophen-2-yl-1,2-oxazole-3-carboxamide;N-[3-[[2-(1H-indol-3-yl)acetyl]amino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;N-[3-[(5-methylfuran-2-carbonyl)amino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;bis(N-[3-[(6-methylpyrazine-2-carbonyl)amino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide);N-[3-[(6-methylpyrazine-2-carbonyl)amino]propyl]-5-thiophen-2-yl-1,2-oxazole-3-carboxamide;N-[3-[(6-methylpyridine-2-carbonyl)amino]propyl]-5-thiophen-2-yl-1,2-oxazole-3-carboxamide;N-[3-(oxane-2-carbonylamino)propyl]-5-thiophen-2-yl-1,2-oxazole-3-carboxamide;5-phenyl-N-[3-[(3-phenylfuran-2-carbonyl)amino]propyl]-1,2-oxazole-3-carboxamide;5-phenyl-N-[3-[(4-phenylpyridine-2-carbonyl)amino]propyl]-1,2-oxazole-3-carboxamide?
The canonical SMILES for N-[3-[(5-ethylfuran-2-carbonyl)amino]propyl]-5-thiophen-2-yl-1,2-oxazole-3-carboxamide;N-[3-[[2-(1H-indol-3-yl)acetyl]amino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;N-[3-[(5-methylfuran-2-carbonyl)amino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;bis(N-[3-[(6-methylpyrazine-2-carbonyl)amino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide);N-[3-[(6-methylpyrazine-2-carbonyl)amino]propyl]-5-thiophen-2-yl-1,2-oxazole-3-carboxamide;N-[3-[(6-methylpyridine-2-carbonyl)amino]propyl]-5-thiophen-2-yl-1,2-oxazole-3-carboxamide;N-[3-(oxane-2-carbonylamino)propyl]-5-thiophen-2-yl-1,2-oxazole-3-carboxamide;5-phenyl-N-[3-[(3-phenylfuran-2-carbonyl)amino]propyl]-1,2-oxazole-3-carboxamide;5-phenyl-N-[3-[(4-phenylpyridine-2-carbonyl)amino]propyl]-1,2-oxazole-3-carboxamide is CCc1ccc(C(=O)NCCCNC(=O)c2cc(-c3cccs3)on2)o1.Cc1ccc(C(=O)NCCCNC(=O)c2cc(-c3ccccc3)on2)o1.Cc1cccc(C(=O)NCCCNC(=O)c2cc(-c3cccs3)on2)n1.Cc1cncc(C(=O)NCCCNC(=O)c2cc(-c3ccccc3)on2)n1.Cc1cncc(C(=O)NCCCNC(=O)c2cc(-c3ccccc3)on2)n1.Cc1cncc(C(=O)NCCCNC(=O)c2cc(-c3cccs3)on2)n1.O=C(Cc1c[nH]c2ccccc12)NCCCNC(=O)c1cc(-c2ccccc2)on1.O=C(NCCCNC(=O)C1CCCCO1)c1cc(-c2cccs2)on1.O=C(NCCCNC(=O)c1cc(-c2ccccc2)on1)c1cc(-c2ccccc2)ccn1.O=C(NCCCNC(=O)c1occc1-c1ccccc1)c1cc(-c2ccccc2)on1.
What is the InChIKey of N-[3-[(5-ethylfuran-2-carbonyl)amino]propyl]-5-thiophen-2-yl-1,2-oxazole-3-carboxamide;N-[3-[[2-(1H-indol-3-yl)acetyl]amino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;N-[3-[(5-methylfuran-2-carbonyl)amino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;bis(N-[3-[(6-methylpyrazine-2-carbonyl)amino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide);N-[3-[(6-methylpyrazine-2-carbonyl)amino]propyl]-5-thiophen-2-yl-1,2-oxazole-3-carboxamide;N-[3-[(6-methylpyridine-2-carbonyl)amino]propyl]-5-thiophen-2-yl-1,2-oxazole-3-carboxamide;N-[3-(oxane-2-carbonylamino)propyl]-5-thiophen-2-yl-1,2-oxazole-3-carboxamide;5-phenyl-N-[3-[(3-phenylfuran-2-carbonyl)amino]propyl]-1,2-oxazole-3-carboxamide;5-phenyl-N-[3-[(4-phenylpyridine-2-carbonyl)amino]propyl]-1,2-oxazole-3-carboxamide?
The InChIKey is FNJHSAHDGBZLHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H22N4O3.C24H21N3O4.C23H22N4O3.2C19H19N5O3.C19H19N3O4.C18H18N4O3S.C18H19N3O4S.C17H17N5O3S.C17H21N3O4S/c30-24(21-16-20(12-15-26-21)18-8-3-1-4-9-18)27-13-7-14-28-25(31)22-17-23(32-29-22)19-10-5-2-6-11-19;28-23(20-16-21(31-27-20)18-10-5-2-6-11-18)25-13-7-14-26-24(29)22-19(12-15-30-22)17-8-3-1-4-9-17;28-22(13-17-15-26-19-10-5-4-9-18(17)19)24-11-6-12-25-23(29)20-14-21(30-27-20)16-7-2-1-3-8-16;2*1-13-11-20-12-16(23-13)19(26)22-9-5-8-21-18(25)15-10-17(27-24-15)14-6-3-2-4-7-14;1-13-8-9-16(25-13)19(24)21-11-5-10-20-18(23)15-12-17(26-22-15)14-6-3-2-4-7-14;1-12-5-2-6-13(21-12)17(23)19-8-4-9-20-18(24)14-11-15(25-22-14)16-7-3-10-26-16;1-2-12-6-7-14(24-12)18(23)20-9-4-8-19-17(22)13-11-15(25-21-13)16-5-3-10-26-16;1-11-9-18-10-13(21-11)17(24)20-6-3-5-19-16(23)12-8-14(25-22-12)15-4-2-7-26-15;21-16(12-11-14(24-20-12)15-6-3-10-25-15)18-7-4-8-19-17(22)13-5-1-2-9-23-13/h1-6,8-12,15-17H,7,13-14H2,(H,27,30)(H,28,31);1-6,8-12,15-16H,7,13-14H2,(H,25,28)(H,26,29);1-5,7-10,14-15,26H,6,11-13H2,(H,24,28)(H,25,29);2*2-4,6-7,10-12H,5,8-9H2,1H3,(H,21,25)(H,22,26);2-4,6-9,12H,5,10-11H2,1H3,(H,20,23)(H,21,24);2-3,5-7,10-11H,4,8-9H2,1H3,(H,19,23)(H,20,24);3,5-7,10-11H,2,4,8-9H2,1H3,(H,19,22)(H,20,23);2,4,7-10H,3,5-6H2,1H3,(H,19,23)(H,20,24);3,6,10-11,13H,1-2,4-5,7-9H2,(H,18,21)(H,19,22).
What are the key properties of N-[3-[(5-ethylfuran-2-carbonyl)amino]propyl]-5-thiophen-2-yl-1,2-oxazole-3-carboxamide;N-[3-[[2-(1H-indol-3-yl)acetyl]amino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;N-[3-[(5-methylfuran-2-carbonyl)amino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;bis(N-[3-[(6-methylpyrazine-2-carbonyl)amino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide);N-[3-[(6-methylpyrazine-2-carbonyl)amino]propyl]-5-thiophen-2-yl-1,2-oxazole-3-carboxamide;N-[3-[(6-methylpyridine-2-carbonyl)amino]propyl]-5-thiophen-2-yl-1,2-oxazole-3-carboxamide;N-[3-(oxane-2-carbonylamino)propyl]-5-thiophen-2-yl-1,2-oxazole-3-carboxamide;5-phenyl-N-[3-[(3-phenylfuran-2-carbonyl)amino]propyl]-1,2-oxazole-3-carboxamide;5-phenyl-N-[3-[(4-phenylpyridine-2-carbonyl)amino]propyl]-1,2-oxazole-3-carboxamide?
N-[3-[(5-ethylfuran-2-carbonyl)amino]propyl]-5-thiophen-2-yl-1,2-oxazole-3-carboxamide;N-[3-[[2-(1H-indol-3-yl)acetyl]amino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;N-[3-[(5-methylfuran-2-carbonyl)amino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;bis(N-[3-[(6-methylpyrazine-2-carbonyl)amino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide);N-[3-[(6-methylpyrazine-2-carbonyl)amino]propyl]-5-thiophen-2-yl-1,2-oxazole-3-carboxamide;N-[3-[(6-methylpyridine-2-carbonyl)amino]propyl]-5-thiophen-2-yl-1,2-oxazole-3-carboxamide;N-[3-(oxane-2-carbonylamino)propyl]-5-thiophen-2-yl-1,2-oxazole-3-carboxamide;5-phenyl-N-[3-[(3-phenylfuran-2-carbonyl)amino]propyl]-1,2-oxazole-3-carboxamide;5-phenyl-N-[3-[(4-phenylpyridine-2-carbonyl)amino]propyl]-1,2-oxazole-3-carboxamide has a molecular weight of 3807.27 g/mol, XLogP of 28.20, 74 rotatable bonds, 21 hydrogen bond donors, and 56 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[(5-ethylfuran-2-carbonyl)amino]propyl]-5-thiophen-2-yl-1,2-oxazole-3-carboxamide;N-[3-[[2-(1H-indol-3-yl)acetyl]amino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;N-[3-[(5-methylfuran-2-carbonyl)amino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide;bis(N-[3-[(6-methylpyrazine-2-carbonyl)amino]propyl]-5-phenyl-1,2-oxazole-3-carboxamide);N-[3-[(6-methylpyrazine-2-carbonyl)amino]propyl]-5-thiophen-2-yl-1,2-oxazole-3-carboxamide;N-[3-[(6-methylpyridine-2-carbonyl)amino]propyl]-5-thiophen-2-yl-1,2-oxazole-3-carboxamide;N-[3-(oxane-2-carbonylamino)propyl]-5-thiophen-2-yl-1,2-oxazole-3-carboxamide;5-phenyl-N-[3-[(3-phenylfuran-2-carbonyl)amino]propyl]-1,2-oxazole-3-carboxamide;5-phenyl-N-[3-[(4-phenylpyridine-2-carbonyl)amino]propyl]-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 158084713), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).