2,5-bis(4-methylphenyl)-1,3,4-oxadiazole;4,7-bis(5-methylthiophen-2-yl)-2,1,3-benzothiadiazole;2,7-dimethyl-9,9-diphenylfluorene;2,5-dimethyl-1,3,4-oxadiazole;2,5-dimethyl-3-phenylthiophene;3,5-dimethyl-4-phenyl-1,2,4-triazole;2,5-dimethylpyrazine;2,5-dimethylpyridine;5,8-dimethylpyrido[3,4-b]pyrazine;2,5-dimethyl-1,3,4-thiadiazole;2,5-dimethylthiophene;4-isocyano-2,5-dimethylbenzonitrile;4-methyl-N-(4-methylphenyl)-N-phenylaniline;1-methyl-4-[(E)-prop-1-enyl]benzene;2,3,5-trimethylthiophene

C164H166N20O2S7 — CID 158048190

About 2,5-bis(4-methylphenyl)-1,3,4-oxadiazole;4,7-bis(5-methylthiophen-2-yl)-2,1,3-benzothiadiazole;2,7-dimethyl-9,9-diphenylfluorene;2,5-dimethyl-1,3,4-oxadiazole;2,5-dimethyl-3-phenylthiophene;3,5-dimethyl-4-phenyl-1,2,4-triazole;2,5-dimethylpyrazine;2,5-dimethylpyridine;5,8-dimethylpyrido[3,4-b]pyrazine;2,5-dimethyl-1,3,4-thiadiazole;2,5-dimethylthiophene;4-isocyano-2,5-dimethylbenzonitrile;4-methyl-N-(4-methylphenyl)-N-phenylaniline;1-methyl-4-[(E)-prop-1-enyl]benzene;2,3,5-trimethylthiophene

2,5-bis(4-methylphenyl)-1,3,4-oxadiazole;4,7-bis(5-methylthiophen-2-yl)-2,1,3-benzothiadiazole;2,7-dimethyl-9,9-diphenylfluorene;2,5-dimethyl-1,3,4-oxadiazole;2,5-dimethyl-3-phenylthiophene;3,5-dimethyl-4-phenyl-1,2,4-triazole;2,5-dimethylpyrazine;2,5-dimethylpyridine;5,8-dimethylpyrido[3,4-b]pyrazine;2,5-dimethyl-1,3,4-thiadiazole;2,5-dimethylthiophene;4-isocyano-2,5-dimethylbenzonitrile;4-methyl-N-(4-methylphenyl)-N-phenylaniline;1-methyl-4-[(E)-prop-1-enyl]benzene;2,3,5-trimethylthiophene (PubChem CID 158048190) has the molecular formula C164H166N20O2S7 and a molecular weight of 2673.74 g/mol. Its IUPAC name is 2,5-bis(4-methylphenyl)-1,3,4-oxadiazole;4,7-bis(5-methylthiophen-2-yl)-2,1,3-benzothiadiazole;2,7-dimethyl-9,9-diphenylfluorene;2,5-dimethyl-1,3,4-oxadiazole;2,5-dimethyl-3-phenylthiophene;3,5-dimethyl-4-phenyl-1,2,4-triazole;2,5-dimethylpyrazine;2,5-dimethylpyridine;5,8-dimethylpyrido[3,4-b]pyrazine;2,5-dimethyl-1,3,4-thiadiazole;2,5-dimethylthiophene;4-isocyano-2,5-dimethylbenzonitrile;4-methyl-N-(4-methylphenyl)-N-phenylaniline;1-methyl-4-[(E)-prop-1-enyl]benzene;2,3,5-trimethylthiophene.

Molecular Properties

• Compound Name: 2,5-bis(4-methylphenyl)-1,3,4-oxadiazole;4,7-bis(5-methylthiophen-2-yl)-2,1,3-benzothiadiazole;2,7-dimethyl-9,9-diphenylfluorene;2,5-dimethyl-1,3,4-oxadiazole;2,5-dimethyl-3-phenylthiophene;3,5-dimethyl-4-phenyl-1,2,4-triazole;2,5-dimethylpyrazine;2,5-dimethylpyridine;5,8-dimethylpyrido[3,4-b]pyrazine;2,5-dimethyl-1,3,4-thiadiazole;2,5-dimethylthiophene;4-isocyano-2,5-dimethylbenzonitrile;4-methyl-N-(4-methylphenyl)-N-phenylaniline;1-methyl-4-[(E)-prop-1-enyl]benzene;2,3,5-trimethylthiophene
• PubChem CID: 158048190
• Molecular Formula: C164H166N20O2S7
• Molecular Weight: 2673.74 g/mol
• Exact Mass: 2671.15
• IUPAC Name: 2,5-bis(4-methylphenyl)-1,3,4-oxadiazole;4,7-bis(5-methylthiophen-2-yl)-2,1,3-benzothiadiazole;2,7-dimethyl-9,9-diphenylfluorene;2,5-dimethyl-1,3,4-oxadiazole;2,5-dimethyl-3-phenylthiophene;3,5-dimethyl-4-phenyl-1,2,4-triazole;2,5-dimethylpyrazine;2,5-dimethylpyridine;5,8-dimethylpyrido[3,4-b]pyrazine;2,5-dimethyl-1,3,4-thiadiazole;2,5-dimethylthiophene;4-isocyano-2,5-dimethylbenzonitrile;4-methyl-N-(4-methylphenyl)-N-phenylaniline;1-methyl-4-[(E)-prop-1-enyl]benzene;2,3,5-trimethylthiophene
• SMILES: C/C=C/c1ccc(C)cc1.Cc1cc(-c2ccccc2)c(C)s1.Cc1cc(C)c(C)s1.Cc1ccc(-c2ccc(-c3ccc(C)s3)c3nsnc23)s1.Cc1ccc(-c2nnc(-c3ccc(C)cc3)o2)cc1.Cc1ccc(C)nc1.Cc1ccc(C)s1.Cc1ccc(N(c2ccccc2)c2ccc(C)cc2)cc1.Cc1ccc2c(c1)C(c1ccccc1)(c1ccccc1)c1cc(C)ccc1-2.Cc1cnc(C)c2nccnc12.Cc1cnc(C)cn1.Cc1nnc(C)n1-c1ccccc1.Cc1nnc(C)o1.Cc1nnc(C)s1.[C-]#[N+]c1cc(C)c(C#N)cc1C
• InChI: InChI=1S/C27H22.C20H19N.C16H14N2O.C16H12N2S3.C12H12S.C10H11N3.C10H8N2.C10H12.C9H9N3.C7H9N.C7H10S.C6H8N2.C6H8S.C4H6N2O.C4H6N2S/c1-19-13-15-23-24-16-14-20(2)18-26(24)27(25(23)17-19,21-9-5-3-6-10-21)22-11-7-4-8-12-22;1-16-8-12-19(13-9-16)21(18-6-4-3-5-7-18)20-14-10-17(2)11-15-20;1-11-3-7-13(8-4-11)15-17-18-16(19-15)14-9-5-12(2)6-10-14;1-9-3-7-13(19-9)11-5-6-12(14-8-4-10(2)20-14)16-15(11)17-21-18-16;1-9-8-12(10(2)13-9)11-6-4-3-5-7-11;1-8-11-12-9(2)13(8)10-6-4-3-5-7-10;1-7-5-10(12-3)8(2)4-9(7)6-11;1-3-4-10-7-5-9(2)6-8-10;1-6-5-12-7(2)9-8(6)10-3-4-11-9;1-6-3-4-7(2)8-5-6;1-5-4-6(2)8-7(5)3;1-5-3-8-6(2)4-7-5;1-5-3-4-6(2)7-5;2*1-3-5-6-4(2)7-3/h3-18H,1-2H3;3-15H,1-2H3;3-10H,1-2H3;3-8H,1-2H3;3-8H,1-2H3;3-7H,1-2H3;4-5H,1-2H3;3-8H,1-2H3;3-5H,1-2H3;3-5H,1-2H3;4H,1-3H3;3-4H,1-2H3;3-4H,1-2H3;2*1-2H3/b;;;;;;;4-3+
• InChIKey: FJDZDVIGDJQQIE-LYPDJJHESA-N
• XLogP: 45.21
• TPSA: 268.84 Ų
• H-Bond Acceptors: 28
• Rotatable Bonds: 12
• Heavy Atoms: 193
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2673.74
LogP ≤ 5	45.21
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	28

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2,5-bis(4-methylphenyl)-1,3,4-oxadiazole;4,7-bis(5-methylthiophen-2-yl)-2,1,3-benzothiadiazole;2,7-dimethyl-9,9-diphenylfluorene;2,5-dimethyl-1,3,4-oxadiazole;2,5-dimethyl-3-phenylthiophene;3,5-dimethyl-4-phenyl-1,2,4-triazole;2,5-dimethylpyrazine;2,5-dimethylpyridine;5,8-dimethylpyrido[3,4-b]pyrazine;2,5-dimethyl-1,3,4-thiadiazole;2,5-dimethylthiophene;4-isocyano-2,5-dimethylbenzonitrile;4-methyl-N-(4-methylphenyl)-N-phenylaniline;1-methyl-4-[(E)-prop-1-enyl]benzene;2,3,5-trimethylthiophene?

The IUPAC name of 2,5-bis(4-methylphenyl)-1,3,4-oxadiazole;4,7-bis(5-methylthiophen-2-yl)-2,1,3-benzothiadiazole;2,7-dimethyl-9,9-diphenylfluorene;2,5-dimethyl-1,3,4-oxadiazole;2,5-dimethyl-3-phenylthiophene;3,5-dimethyl-4-phenyl-1,2,4-triazole;2,5-dimethylpyrazine;2,5-dimethylpyridine;5,8-dimethylpyrido[3,4-b]pyrazine;2,5-dimethyl-1,3,4-thiadiazole;2,5-dimethylthiophene;4-isocyano-2,5-dimethylbenzonitrile;4-methyl-N-(4-methylphenyl)-N-phenylaniline;1-methyl-4-[(E)-prop-1-enyl]benzene;2,3,5-trimethylthiophene (CID 158048190) is 2,5-bis(4-methylphenyl)-1,3,4-oxadiazole;4,7-bis(5-methylthiophen-2-yl)-2,1,3-benzothiadiazole;2,7-dimethyl-9,9-diphenylfluorene;2,5-dimethyl-1,3,4-oxadiazole;2,5-dimethyl-3-phenylthiophene;3,5-dimethyl-4-phenyl-1,2,4-triazole;2,5-dimethylpyrazine;2,5-dimethylpyridine;5,8-dimethylpyrido[3,4-b]pyrazine;2,5-dimethyl-1,3,4-thiadiazole;2,5-dimethylthiophene;4-isocyano-2,5-dimethylbenzonitrile;4-methyl-N-(4-methylphenyl)-N-phenylaniline;1-methyl-4-[(E)-prop-1-enyl]benzene;2,3,5-trimethylthiophene.

What is the SMILES notation for 2,5-bis(4-methylphenyl)-1,3,4-oxadiazole;4,7-bis(5-methylthiophen-2-yl)-2,1,3-benzothiadiazole;2,7-dimethyl-9,9-diphenylfluorene;2,5-dimethyl-1,3,4-oxadiazole;2,5-dimethyl-3-phenylthiophene;3,5-dimethyl-4-phenyl-1,2,4-triazole;2,5-dimethylpyrazine;2,5-dimethylpyridine;5,8-dimethylpyrido[3,4-b]pyrazine;2,5-dimethyl-1,3,4-thiadiazole;2,5-dimethylthiophene;4-isocyano-2,5-dimethylbenzonitrile;4-methyl-N-(4-methylphenyl)-N-phenylaniline;1-methyl-4-[(E)-prop-1-enyl]benzene;2,3,5-trimethylthiophene?

The canonical SMILES for 2,5-bis(4-methylphenyl)-1,3,4-oxadiazole;4,7-bis(5-methylthiophen-2-yl)-2,1,3-benzothiadiazole;2,7-dimethyl-9,9-diphenylfluorene;2,5-dimethyl-1,3,4-oxadiazole;2,5-dimethyl-3-phenylthiophene;3,5-dimethyl-4-phenyl-1,2,4-triazole;2,5-dimethylpyrazine;2,5-dimethylpyridine;5,8-dimethylpyrido[3,4-b]pyrazine;2,5-dimethyl-1,3,4-thiadiazole;2,5-dimethylthiophene;4-isocyano-2,5-dimethylbenzonitrile;4-methyl-N-(4-methylphenyl)-N-phenylaniline;1-methyl-4-[(E)-prop-1-enyl]benzene;2,3,5-trimethylthiophene is C/C=C/c1ccc(C)cc1.Cc1cc(-c2ccccc2)c(C)s1.Cc1cc(C)c(C)s1.Cc1ccc(-c2ccc(-c3ccc(C)s3)c3nsnc23)s1.Cc1ccc(-c2nnc(-c3ccc(C)cc3)o2)cc1.Cc1ccc(C)nc1.Cc1ccc(C)s1.Cc1ccc(N(c2ccccc2)c2ccc(C)cc2)cc1.Cc1ccc2c(c1)C(c1ccccc1)(c1ccccc1)c1cc(C)ccc1-2.Cc1cnc(C)c2nccnc12.Cc1cnc(C)cn1.Cc1nnc(C)n1-c1ccccc1.Cc1nnc(C)o1.Cc1nnc(C)s1.[C-]#[N+]c1cc(C)c(C#N)cc1C.

What is the InChIKey of 2,5-bis(4-methylphenyl)-1,3,4-oxadiazole;4,7-bis(5-methylthiophen-2-yl)-2,1,3-benzothiadiazole;2,7-dimethyl-9,9-diphenylfluorene;2,5-dimethyl-1,3,4-oxadiazole;2,5-dimethyl-3-phenylthiophene;3,5-dimethyl-4-phenyl-1,2,4-triazole;2,5-dimethylpyrazine;2,5-dimethylpyridine;5,8-dimethylpyrido[3,4-b]pyrazine;2,5-dimethyl-1,3,4-thiadiazole;2,5-dimethylthiophene;4-isocyano-2,5-dimethylbenzonitrile;4-methyl-N-(4-methylphenyl)-N-phenylaniline;1-methyl-4-[(E)-prop-1-enyl]benzene;2,3,5-trimethylthiophene?

The InChIKey is FJDZDVIGDJQQIE-LYPDJJHESA-N. The full InChI is InChI=1S/C27H22.C20H19N.C16H14N2O.C16H12N2S3.C12H12S.C10H11N3.C10H8N2.C10H12.C9H9N3.C7H9N.C7H10S.C6H8N2.C6H8S.C4H6N2O.C4H6N2S/c1-19-13-15-23-24-16-14-20(2)18-26(24)27(25(23)17-19,21-9-5-3-6-10-21)22-11-7-4-8-12-22;1-16-8-12-19(13-9-16)21(18-6-4-3-5-7-18)20-14-10-17(2)11-15-20;1-11-3-7-13(8-4-11)15-17-18-16(19-15)14-9-5-12(2)6-10-14;1-9-3-7-13(19-9)11-5-6-12(14-8-4-10(2)20-14)16-15(11)17-21-18-16;1-9-8-12(10(2)13-9)11-6-4-3-5-7-11;1-8-11-12-9(2)13(8)10-6-4-3-5-7-10;1-7-5-10(12-3)8(2)4-9(7)6-11;1-3-4-10-7-5-9(2)6-8-10;1-6-5-12-7(2)9-8(6)10-3-4-11-9;1-6-3-4-7(2)8-5-6;1-5-4-6(2)8-7(5)3;1-5-3-8-6(2)4-7-5;1-5-3-4-6(2)7-5;2*1-3-5-6-4(2)7-3/h3-18H,1-2H3;3-15H,1-2H3;3-10H,1-2H3;3-8H,1-2H3;3-8H,1-2H3;3-7H,1-2H3;4-5H,1-2H3;3-8H,1-2H3;3-5H,1-2H3;3-5H,1-2H3;4H,1-3H3;3-4H,1-2H3;3-4H,1-2H3;2*1-2H3/b;;;;;;;4-3+;;;;;;;.

What are the key properties of 2,5-bis(4-methylphenyl)-1,3,4-oxadiazole;4,7-bis(5-methylthiophen-2-yl)-2,1,3-benzothiadiazole;2,7-dimethyl-9,9-diphenylfluorene;2,5-dimethyl-1,3,4-oxadiazole;2,5-dimethyl-3-phenylthiophene;3,5-dimethyl-4-phenyl-1,2,4-triazole;2,5-dimethylpyrazine;2,5-dimethylpyridine;5,8-dimethylpyrido[3,4-b]pyrazine;2,5-dimethyl-1,3,4-thiadiazole;2,5-dimethylthiophene;4-isocyano-2,5-dimethylbenzonitrile;4-methyl-N-(4-methylphenyl)-N-phenylaniline;1-methyl-4-[(E)-prop-1-enyl]benzene;2,3,5-trimethylthiophene?

2,5-bis(4-methylphenyl)-1,3,4-oxadiazole;4,7-bis(5-methylthiophen-2-yl)-2,1,3-benzothiadiazole;2,7-dimethyl-9,9-diphenylfluorene;2,5-dimethyl-1,3,4-oxadiazole;2,5-dimethyl-3-phenylthiophene;3,5-dimethyl-4-phenyl-1,2,4-triazole;2,5-dimethylpyrazine;2,5-dimethylpyridine;5,8-dimethylpyrido[3,4-b]pyrazine;2,5-dimethyl-1,3,4-thiadiazole;2,5-dimethylthiophene;4-isocyano-2,5-dimethylbenzonitrile;4-methyl-N-(4-methylphenyl)-N-phenylaniline;1-methyl-4-[(E)-prop-1-enyl]benzene;2,3,5-trimethylthiophene has a molecular weight of 2673.74 g/mol, XLogP of 45.21, 12 rotatable bonds, 0 hydrogen bond donors, and 28 hydrogen bond acceptors.

Where does this data come from?

All data for 2,5-bis(4-methylphenyl)-1,3,4-oxadiazole;4,7-bis(5-methylthiophen-2-yl)-2,1,3-benzothiadiazole;2,7-dimethyl-9,9-diphenylfluorene;2,5-dimethyl-1,3,4-oxadiazole;2,5-dimethyl-3-phenylthiophene;3,5-dimethyl-4-phenyl-1,2,4-triazole;2,5-dimethylpyrazine;2,5-dimethylpyridine;5,8-dimethylpyrido[3,4-b]pyrazine;2,5-dimethyl-1,3,4-thiadiazole;2,5-dimethylthiophene;4-isocyano-2,5-dimethylbenzonitrile;4-methyl-N-(4-methylphenyl)-N-phenylaniline;1-methyl-4-[(E)-prop-1-enyl]benzene;2,3,5-trimethylthiophene is sourced from PubChem (CID 158048190), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).