N,N-dimethyl-3-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)aniline;5-[3-(furan-2-yl)phenyl]-3-pyridin-4-yl-1,2,4-oxadiazole;5-(5-methyl-4-phenylthiophen-2-yl)-3-(3-methyl-4-pyridinyl)-1,2,4-oxadiazole;N-methyl-3-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)aniline;5-[3-(1,3-oxazol-4-yl)phenyl]-3-pyridin-4-yl-1,2,4-oxadiazole;3-pyridin-4-yl-5-(3-pyrrolidin-1-ylphenyl)-1,2,4-oxadiazole;3-pyridin-4-yl-5-(4-pyrrolidin-1-ylphenyl)-1,2,4-oxadiazole;3-pyridin-4-yl-5-(3-thiophen-2-ylphenyl)-1,2,4-oxadiazole

C132H105N29O10S2 — CID 158065124

IUPACN,N-dimethyl-3-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)aniline;5-[3-(furan-2-yl)phenyl]-3-pyridin-4-yl-1,2,4-oxadiazole;5-(5-methyl-4-phenylthiophen-2-yl)-3-(3-methyl-4-pyridinyl)-1,2,4-oxadiazole;N-methyl-3-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)aniline;5-[3-(1,3-oxazol-4-yl)phenyl]-3-pyridin-4-yl-1,2,4-oxadiazole;3-pyridin-4-yl-5-(3-pyrrolidin-1-ylphenyl)-1,2,4-oxadiazole;3-pyridin-4-yl-5-(4-pyrrolidin-1-ylphenyl)-1,2,4-oxadiazole;3-pyridin-4-yl-5-(3-thiophen-2-ylphenyl)-1,2,4-oxadiazole
SMILESCN(C)c1cccc(-c2nc(-c3ccncc3)no2)c1.CNc1cccc(-c2nc(-c3ccncc3)no2)c1.Cc1cnccc1-c1noc(-c2cc(-c3ccccc3)c(C)s2)n1.c1cc(-c2ccco2)cc(-c2nc(-c3ccncc3)no2)c1.c1cc(-c2cocn2)cc(-c2nc(-c3ccncc3)no2)c1.c1cc(-c2nc(-c3ccncc3)no2)cc(-c2cccs2)c1.c1cc(-c2nc(-c3ccncc3)no2)cc(N2CCCC2)c1.c1cc(-c2noc(-c3ccc(N4CCCC4)cc3)n2)ccn1
InChIInChI=1S/C19H15N3OS.2C17H16N4O.C17H11N3O2.C17H11N3OS.C16H10N4O2.C15H14N4O.C14H12N4O/c1-12-11-20-9-8-15(12)18-21-19(23-22-18)17-10-16(13(2)24-17)14-6-4-3-5-7-14;1-2-12-21(11-1)15-5-3-14(4-6-15)17-19-16(20-22-17)13-7-9-18-10-8-13;1-2-11-21(10-1)15-5-3-4-14(12-15)17-19-16(20-22-17)13-6-8-18-9-7-13;1-3-13(15-5-2-10-21-15)11-14(4-1)17-19-16(20-22-17)12-6-8-18-9-7-12;1-3-13(15-5-2-10-22-15)11-14(4-1)17-19-16(20-21-17)12-6-8-18-9-7-12;1-2-12(14-9-21-10-18-14)8-13(3-1)16-19-15(20-22-16)11-4-6-17-7-5-11;1-19(2)13-5-3-4-12(10-13)15-17-14(18-20-15)11-6-8-16-9-7-11;1-15-12-4-2-3-11(9-12)14-17-13(18-19-14)10-5-7-16-8-6-10/h3-11H,1-2H3;3-10H,1-2,11-12H2;3-9,12H,1-2,10-11H2;2*1-11H;1-10H;3-10H,1-2H3;2-9,15H,1H3
InChIKeyFLDAIWDRZVDDML-UHFFFAOYSA-N
MW2321.62 g/mol
LogP29.69
Rot. Bonds24

About N,N-dimethyl-3-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)aniline;5-[3-(furan-2-yl)phenyl]-3-pyridin-4-yl-1,2,4-oxadiazole;5-(5-methyl-4-phenylthiophen-2-yl)-3-(3-methyl-4-pyridinyl)-1,2,4-oxadiazole;N-methyl-3-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)aniline;5-[3-(1,3-oxazol-4-yl)phenyl]-3-pyridin-4-yl-1,2,4-oxadiazole;3-pyridin-4-yl-5-(3-pyrrolidin-1-ylphenyl)-1,2,4-oxadiazole;3-pyridin-4-yl-5-(4-pyrrolidin-1-ylphenyl)-1,2,4-oxadiazole;3-pyridin-4-yl-5-(3-thiophen-2-ylphenyl)-1,2,4-oxadiazole

N,N-dimethyl-3-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)aniline;5-[3-(furan-2-yl)phenyl]-3-pyridin-4-yl-1,2,4-oxadiazole;5-(5-methyl-4-phenylthiophen-2-yl)-3-(3-methyl-4-pyridinyl)-1,2,4-oxadiazole;N-methyl-3-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)aniline;5-[3-(1,3-oxazol-4-yl)phenyl]-3-pyridin-4-yl-1,2,4-oxadiazole;3-pyridin-4-yl-5-(3-pyrrolidin-1-ylphenyl)-1,2,4-oxadiazole;3-pyridin-4-yl-5-(4-pyrrolidin-1-ylphenyl)-1,2,4-oxadiazole;3-pyridin-4-yl-5-(3-thiophen-2-ylphenyl)-1,2,4-oxadiazole (PubChem CID 158065124) has the molecular formula C132H105N29O10S2 and a molecular weight of 2321.62 g/mol. Its IUPAC name is N,N-dimethyl-3-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)aniline;5-[3-(furan-2-yl)phenyl]-3-pyridin-4-yl-1,2,4-oxadiazole;5-(5-methyl-4-phenylthiophen-2-yl)-3-(3-methyl-4-pyridinyl)-1,2,4-oxadiazole;N-methyl-3-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)aniline;5-[3-(1,3-oxazol-4-yl)phenyl]-3-pyridin-4-yl-1,2,4-oxadiazole;3-pyridin-4-yl-5-(3-pyrrolidin-1-ylphenyl)-1,2,4-oxadiazole;3-pyridin-4-yl-5-(4-pyrrolidin-1-ylphenyl)-1,2,4-oxadiazole;3-pyridin-4-yl-5-(3-thiophen-2-ylphenyl)-1,2,4-oxadiazole.

Molecular Properties

Compound NameN,N-dimethyl-3-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)aniline;5-[3-(furan-2-yl)phenyl]-3-pyridin-4-yl-1,2,4-oxadiazole;5-(5-methyl-4-phenylthiophen-2-yl)-3-(3-methyl-4-pyridinyl)-1,2,4-oxadiazole;N-methyl-3-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)aniline;5-[3-(1,3-oxazol-4-yl)phenyl]-3-pyridin-4-yl-1,2,4-oxadiazole;3-pyridin-4-yl-5-(3-pyrrolidin-1-ylphenyl)-1,2,4-oxadiazole;3-pyridin-4-yl-5-(4-pyrrolidin-1-ylphenyl)-1,2,4-oxadiazole;3-pyridin-4-yl-5-(3-thiophen-2-ylphenyl)-1,2,4-oxadiazole
PubChem CID158065124
Molecular FormulaC132H105N29O10S2
Molecular Weight2321.62 g/mol
Exact Mass2319.80
IUPAC NameN,N-dimethyl-3-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)aniline;5-[3-(furan-2-yl)phenyl]-3-pyridin-4-yl-1,2,4-oxadiazole;5-(5-methyl-4-phenylthiophen-2-yl)-3-(3-methyl-4-pyridinyl)-1,2,4-oxadiazole;N-methyl-3-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)aniline;5-[3-(1,3-oxazol-4-yl)phenyl]-3-pyridin-4-yl-1,2,4-oxadiazole;3-pyridin-4-yl-5-(3-pyrrolidin-1-ylphenyl)-1,2,4-oxadiazole;3-pyridin-4-yl-5-(4-pyrrolidin-1-ylphenyl)-1,2,4-oxadiazole;3-pyridin-4-yl-5-(3-thiophen-2-ylphenyl)-1,2,4-oxadiazole
SMILESCN(C)c1cccc(-c2nc(-c3ccncc3)no2)c1.CNc1cccc(-c2nc(-c3ccncc3)no2)c1.Cc1cnccc1-c1noc(-c2cc(-c3ccccc3)c(C)s2)n1.c1cc(-c2ccco2)cc(-c2nc(-c3ccncc3)no2)c1.c1cc(-c2cocn2)cc(-c2nc(-c3ccncc3)no2)c1.c1cc(-c2nc(-c3ccncc3)no2)cc(-c2cccs2)c1.c1cc(-c2nc(-c3ccncc3)no2)cc(N2CCCC2)c1.c1cc(-c2noc(-c3ccc(N4CCCC4)cc3)n2)ccn1
InChIInChI=1S/C19H15N3OS.2C17H16N4O.C17H11N3O2.C17H11N3OS.C16H10N4O2.C15H14N4O.C14H12N4O/c1-12-11-20-9-8-15(12)18-21-19(23-22-18)17-10-16(13(2)24-17)14-6-4-3-5-7-14;1-2-12-21(11-1)15-5-3-14(4-6-15)17-19-16(20-22-17)13-7-9-18-10-8-13;1-2-11-21(10-1)15-5-3-4-14(12-15)17-19-16(20-22-17)13-6-8-18-9-7-13;1-3-13(15-5-2-10-21-15)11-14(4-1)17-19-16(20-22-17)12-6-8-18-9-7-12;1-3-13(15-5-2-10-22-15)11-14(4-1)17-19-16(20-21-17)12-6-8-18-9-7-12;1-2-12(14-9-21-10-18-14)8-13(3-1)16-19-15(20-22-16)11-4-6-17-7-5-11;1-19(2)13-5-3-4-12(10-13)15-17-14(18-20-15)11-6-8-16-9-7-11;1-15-12-4-2-3-11(9-12)14-17-13(18-19-14)10-5-7-16-8-6-10/h3-11H,1-2H3;3-10H,1-2,11-12H2;3-9,12H,1-2,10-11H2;2*1-11H;1-10H;3-10H,1-2H3;2-9,15H,1H3
InChIKeyFLDAIWDRZVDDML-UHFFFAOYSA-N
XLogP29.69
TPSA475.40 Ų
H-Bond Donors1
H-Bond Acceptors41
Rotatable Bonds24
Heavy Atoms173
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002321.62
LogP ≤ 529.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1041

Analyze N,N-dimethyl-3-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)aniline;5-[3-(furan-2-yl)phenyl]-3-pyridin-4-yl-1,2,4-oxadiazole;5-(5-methyl-4-phenylthiophen-2-yl)-3-(3-methyl-4-pyridinyl)-1,2,4-oxadiazole;N-methyl-3-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)aniline;5-[3-(1,3-oxazol-4-yl)phenyl]-3-pyridin-4-yl-1,2,4-oxadiazole;3-pyridin-4-yl-5-(3-pyrrolidin-1-ylphenyl)-1,2,4-oxadiazole;3-pyridin-4-yl-5-(4-pyrrolidin-1-ylphenyl)-1,2,4-oxadiazole;3-pyridin-4-yl-5-(3-thiophen-2-ylphenyl)-1,2,4-oxadiazole with MolForge

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-3-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)aniline;5-[3-(furan-2-yl)phenyl]-3-pyridin-4-yl-1,2,4-oxadiazole;5-(5-methyl-4-phenylthiophen-2-yl)-3-(3-methyl-4-pyridinyl)-1,2,4-oxadiazole;N-methyl-3-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)aniline;5-[3-(1,3-oxazol-4-yl)phenyl]-3-pyridin-4-yl-1,2,4-oxadiazole;3-pyridin-4-yl-5-(3-pyrrolidin-1-ylphenyl)-1,2,4-oxadiazole;3-pyridin-4-yl-5-(4-pyrrolidin-1-ylphenyl)-1,2,4-oxadiazole;3-pyridin-4-yl-5-(3-thiophen-2-ylphenyl)-1,2,4-oxadiazole?
The IUPAC name of N,N-dimethyl-3-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)aniline;5-[3-(furan-2-yl)phenyl]-3-pyridin-4-yl-1,2,4-oxadiazole;5-(5-methyl-4-phenylthiophen-2-yl)-3-(3-methyl-4-pyridinyl)-1,2,4-oxadiazole;N-methyl-3-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)aniline;5-[3-(1,3-oxazol-4-yl)phenyl]-3-pyridin-4-yl-1,2,4-oxadiazole;3-pyridin-4-yl-5-(3-pyrrolidin-1-ylphenyl)-1,2,4-oxadiazole;3-pyridin-4-yl-5-(4-pyrrolidin-1-ylphenyl)-1,2,4-oxadiazole;3-pyridin-4-yl-5-(3-thiophen-2-ylphenyl)-1,2,4-oxadiazole (CID 158065124) is N,N-dimethyl-3-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)aniline;5-[3-(furan-2-yl)phenyl]-3-pyridin-4-yl-1,2,4-oxadiazole;5-(5-methyl-4-phenylthiophen-2-yl)-3-(3-methyl-4-pyridinyl)-1,2,4-oxadiazole;N-methyl-3-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)aniline;5-[3-(1,3-oxazol-4-yl)phenyl]-3-pyridin-4-yl-1,2,4-oxadiazole;3-pyridin-4-yl-5-(3-pyrrolidin-1-ylphenyl)-1,2,4-oxadiazole;3-pyridin-4-yl-5-(4-pyrrolidin-1-ylphenyl)-1,2,4-oxadiazole;3-pyridin-4-yl-5-(3-thiophen-2-ylphenyl)-1,2,4-oxadiazole.
What is the SMILES notation for N,N-dimethyl-3-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)aniline;5-[3-(furan-2-yl)phenyl]-3-pyridin-4-yl-1,2,4-oxadiazole;5-(5-methyl-4-phenylthiophen-2-yl)-3-(3-methyl-4-pyridinyl)-1,2,4-oxadiazole;N-methyl-3-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)aniline;5-[3-(1,3-oxazol-4-yl)phenyl]-3-pyridin-4-yl-1,2,4-oxadiazole;3-pyridin-4-yl-5-(3-pyrrolidin-1-ylphenyl)-1,2,4-oxadiazole;3-pyridin-4-yl-5-(4-pyrrolidin-1-ylphenyl)-1,2,4-oxadiazole;3-pyridin-4-yl-5-(3-thiophen-2-ylphenyl)-1,2,4-oxadiazole?
The canonical SMILES for N,N-dimethyl-3-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)aniline;5-[3-(furan-2-yl)phenyl]-3-pyridin-4-yl-1,2,4-oxadiazole;5-(5-methyl-4-phenylthiophen-2-yl)-3-(3-methyl-4-pyridinyl)-1,2,4-oxadiazole;N-methyl-3-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)aniline;5-[3-(1,3-oxazol-4-yl)phenyl]-3-pyridin-4-yl-1,2,4-oxadiazole;3-pyridin-4-yl-5-(3-pyrrolidin-1-ylphenyl)-1,2,4-oxadiazole;3-pyridin-4-yl-5-(4-pyrrolidin-1-ylphenyl)-1,2,4-oxadiazole;3-pyridin-4-yl-5-(3-thiophen-2-ylphenyl)-1,2,4-oxadiazole is CN(C)c1cccc(-c2nc(-c3ccncc3)no2)c1.CNc1cccc(-c2nc(-c3ccncc3)no2)c1.Cc1cnccc1-c1noc(-c2cc(-c3ccccc3)c(C)s2)n1.c1cc(-c2ccco2)cc(-c2nc(-c3ccncc3)no2)c1.c1cc(-c2cocn2)cc(-c2nc(-c3ccncc3)no2)c1.c1cc(-c2nc(-c3ccncc3)no2)cc(-c2cccs2)c1.c1cc(-c2nc(-c3ccncc3)no2)cc(N2CCCC2)c1.c1cc(-c2noc(-c3ccc(N4CCCC4)cc3)n2)ccn1.
What is the InChIKey of N,N-dimethyl-3-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)aniline;5-[3-(furan-2-yl)phenyl]-3-pyridin-4-yl-1,2,4-oxadiazole;5-(5-methyl-4-phenylthiophen-2-yl)-3-(3-methyl-4-pyridinyl)-1,2,4-oxadiazole;N-methyl-3-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)aniline;5-[3-(1,3-oxazol-4-yl)phenyl]-3-pyridin-4-yl-1,2,4-oxadiazole;3-pyridin-4-yl-5-(3-pyrrolidin-1-ylphenyl)-1,2,4-oxadiazole;3-pyridin-4-yl-5-(4-pyrrolidin-1-ylphenyl)-1,2,4-oxadiazole;3-pyridin-4-yl-5-(3-thiophen-2-ylphenyl)-1,2,4-oxadiazole?
The InChIKey is FLDAIWDRZVDDML-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15N3OS.2C17H16N4O.C17H11N3O2.C17H11N3OS.C16H10N4O2.C15H14N4O.C14H12N4O/c1-12-11-20-9-8-15(12)18-21-19(23-22-18)17-10-16(13(2)24-17)14-6-4-3-5-7-14;1-2-12-21(11-1)15-5-3-14(4-6-15)17-19-16(20-22-17)13-7-9-18-10-8-13;1-2-11-21(10-1)15-5-3-4-14(12-15)17-19-16(20-22-17)13-6-8-18-9-7-13;1-3-13(15-5-2-10-21-15)11-14(4-1)17-19-16(20-22-17)12-6-8-18-9-7-12;1-3-13(15-5-2-10-22-15)11-14(4-1)17-19-16(20-21-17)12-6-8-18-9-7-12;1-2-12(14-9-21-10-18-14)8-13(3-1)16-19-15(20-22-16)11-4-6-17-7-5-11;1-19(2)13-5-3-4-12(10-13)15-17-14(18-20-15)11-6-8-16-9-7-11;1-15-12-4-2-3-11(9-12)14-17-13(18-19-14)10-5-7-16-8-6-10/h3-11H,1-2H3;3-10H,1-2,11-12H2;3-9,12H,1-2,10-11H2;2*1-11H;1-10H;3-10H,1-2H3;2-9,15H,1H3.
What are the key properties of N,N-dimethyl-3-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)aniline;5-[3-(furan-2-yl)phenyl]-3-pyridin-4-yl-1,2,4-oxadiazole;5-(5-methyl-4-phenylthiophen-2-yl)-3-(3-methyl-4-pyridinyl)-1,2,4-oxadiazole;N-methyl-3-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)aniline;5-[3-(1,3-oxazol-4-yl)phenyl]-3-pyridin-4-yl-1,2,4-oxadiazole;3-pyridin-4-yl-5-(3-pyrrolidin-1-ylphenyl)-1,2,4-oxadiazole;3-pyridin-4-yl-5-(4-pyrrolidin-1-ylphenyl)-1,2,4-oxadiazole;3-pyridin-4-yl-5-(3-thiophen-2-ylphenyl)-1,2,4-oxadiazole?
N,N-dimethyl-3-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)aniline;5-[3-(furan-2-yl)phenyl]-3-pyridin-4-yl-1,2,4-oxadiazole;5-(5-methyl-4-phenylthiophen-2-yl)-3-(3-methyl-4-pyridinyl)-1,2,4-oxadiazole;N-methyl-3-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)aniline;5-[3-(1,3-oxazol-4-yl)phenyl]-3-pyridin-4-yl-1,2,4-oxadiazole;3-pyridin-4-yl-5-(3-pyrrolidin-1-ylphenyl)-1,2,4-oxadiazole;3-pyridin-4-yl-5-(4-pyrrolidin-1-ylphenyl)-1,2,4-oxadiazole;3-pyridin-4-yl-5-(3-thiophen-2-ylphenyl)-1,2,4-oxadiazole has a molecular weight of 2321.62 g/mol, XLogP of 29.69, 24 rotatable bonds, 1 hydrogen bond donors, and 41 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-3-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)aniline;5-[3-(furan-2-yl)phenyl]-3-pyridin-4-yl-1,2,4-oxadiazole;5-(5-methyl-4-phenylthiophen-2-yl)-3-(3-methyl-4-pyridinyl)-1,2,4-oxadiazole;N-methyl-3-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)aniline;5-[3-(1,3-oxazol-4-yl)phenyl]-3-pyridin-4-yl-1,2,4-oxadiazole;3-pyridin-4-yl-5-(3-pyrrolidin-1-ylphenyl)-1,2,4-oxadiazole;3-pyridin-4-yl-5-(4-pyrrolidin-1-ylphenyl)-1,2,4-oxadiazole;3-pyridin-4-yl-5-(3-thiophen-2-ylphenyl)-1,2,4-oxadiazole is sourced from PubChem (CID 158065124), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).