3,5-dimethyl-1,2,4-oxadiazole;2,5-dimethyl-1,3-oxazole;5-methyl-3-phenyl-1,2,4-oxadiazole;5-methyl-2-phenyl-1,3-oxazole;2-methyl-1,3,4,5-tetraphenylpyrrole;3-methyl-1,2,4,5-tetraphenylpyrrole;bis(1,2,3,4,5-pentamethylpyrrole);1,2,4-trimethyl-3,5-diphenylpyrrole;1,3,4-trimethyl-2,5-diphenylpyrrole;bis(2,3,5-trimethyl-1,4-diphenylpyrrole)

C180H182N14O4 — CID 158411587

About 3,5-dimethyl-1,2,4-oxadiazole;2,5-dimethyl-1,3-oxazole;5-methyl-3-phenyl-1,2,4-oxadiazole;5-methyl-2-phenyl-1,3-oxazole;2-methyl-1,3,4,5-tetraphenylpyrrole;3-methyl-1,2,4,5-tetraphenylpyrrole;bis(1,2,3,4,5-pentamethylpyrrole);1,2,4-trimethyl-3,5-diphenylpyrrole;1,3,4-trimethyl-2,5-diphenylpyrrole;bis(2,3,5-trimethyl-1,4-diphenylpyrrole)

3,5-dimethyl-1,2,4-oxadiazole;2,5-dimethyl-1,3-oxazole;5-methyl-3-phenyl-1,2,4-oxadiazole;5-methyl-2-phenyl-1,3-oxazole;2-methyl-1,3,4,5-tetraphenylpyrrole;3-methyl-1,2,4,5-tetraphenylpyrrole;bis(1,2,3,4,5-pentamethylpyrrole);1,2,4-trimethyl-3,5-diphenylpyrrole;1,3,4-trimethyl-2,5-diphenylpyrrole;bis(2,3,5-trimethyl-1,4-diphenylpyrrole) (PubChem CID 158411587) has the molecular formula C180H182N14O4 and a molecular weight of 2605.53 g/mol. Its IUPAC name is 3,5-dimethyl-1,2,4-oxadiazole;2,5-dimethyl-1,3-oxazole;5-methyl-3-phenyl-1,2,4-oxadiazole;5-methyl-2-phenyl-1,3-oxazole;2-methyl-1,3,4,5-tetraphenylpyrrole;3-methyl-1,2,4,5-tetraphenylpyrrole;bis(1,2,3,4,5-pentamethylpyrrole);1,2,4-trimethyl-3,5-diphenylpyrrole;1,3,4-trimethyl-2,5-diphenylpyrrole;bis(2,3,5-trimethyl-1,4-diphenylpyrrole).

Molecular Properties

• Compound Name: 3,5-dimethyl-1,2,4-oxadiazole;2,5-dimethyl-1,3-oxazole;5-methyl-3-phenyl-1,2,4-oxadiazole;5-methyl-2-phenyl-1,3-oxazole;2-methyl-1,3,4,5-tetraphenylpyrrole;3-methyl-1,2,4,5-tetraphenylpyrrole;bis(1,2,3,4,5-pentamethylpyrrole);1,2,4-trimethyl-3,5-diphenylpyrrole;1,3,4-trimethyl-2,5-diphenylpyrrole;bis(2,3,5-trimethyl-1,4-diphenylpyrrole)
• PubChem CID: 158411587
• Molecular Formula: C180H182N14O4
• Molecular Weight: 2605.53 g/mol
• Exact Mass: 2603.45
• IUPAC Name: 3,5-dimethyl-1,2,4-oxadiazole;2,5-dimethyl-1,3-oxazole;5-methyl-3-phenyl-1,2,4-oxadiazole;5-methyl-2-phenyl-1,3-oxazole;2-methyl-1,3,4,5-tetraphenylpyrrole;3-methyl-1,2,4,5-tetraphenylpyrrole;bis(1,2,3,4,5-pentamethylpyrrole);1,2,4-trimethyl-3,5-diphenylpyrrole;1,3,4-trimethyl-2,5-diphenylpyrrole;bis(2,3,5-trimethyl-1,4-diphenylpyrrole)
• SMILES: Cc1c(-c2ccccc2)c(-c2ccccc2)c(-c2ccccc2)n1-c1ccccc1.Cc1c(-c2ccccc2)c(-c2ccccc2)n(-c2ccccc2)c1-c1ccccc1.Cc1c(-c2ccccc2)c(C)n(-c2ccccc2)c1C.Cc1c(-c2ccccc2)c(C)n(-c2ccccc2)c1C.Cc1c(-c2ccccc2)c(C)n(C)c1-c1ccccc1.Cc1c(C)c(-c2ccccc2)n(C)c1-c1ccccc1.Cc1c(C)c(C)n(C)c1C.Cc1c(C)c(C)n(C)c1C.Cc1cnc(-c2ccccc2)o1.Cc1cnc(C)o1.Cc1nc(-c2ccccc2)no1.Cc1noc(C)n1
• InChI: InChI=1S/2C29H23N.4C19H19N.C10H9NO.C9H8N2O.2C9H15N.C5H7NO.C4H6N2O/c1-22-27(23-14-6-2-7-15-23)28(24-16-8-3-9-17-24)29(25-18-10-4-11-19-25)30(22)26-20-12-5-13-21-26;1-22-27(23-14-6-2-7-15-23)29(25-18-10-4-11-19-25)30(26-20-12-5-13-21-26)28(22)24-16-8-3-9-17-24;1-14-18(16-10-6-4-7-11-16)15(2)20(3)19(14)17-12-8-5-9-13-17;1-14-15(2)19(17-12-8-5-9-13-17)20(3)18(14)16-10-6-4-7-11-16;2*1-14-15(2)20(18-12-8-5-9-13-18)16(3)19(14)17-10-6-4-7-11-17;1-8-7-11-10(12-8)9-5-3-2-4-6-9;1-7-10-9(11-12-7)8-5-3-2-4-6-8;2*1-6-7(2)9(4)10(5)8(6)3;1-4-3-6-5(2)7-4;1-3-5-4(2)7-6-3/h2*2-21H,1H3;4*4-13H,1-3H3;2-7H,1H3;2-6H,1H3;2*1-5H3;3H,1-2H3;1-2H3
• InChIKey: GZJOMBHXIIMOCR-UHFFFAOYSA-N
• XLogP: 46.85
• TPSA: 169.34 Ų
• H-Bond Acceptors: 18
• Rotatable Bonds: 18
• Heavy Atoms: 198
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2605.53
LogP ≤ 5	46.85
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	18

Frequently Asked Questions

What is the IUPAC name of 3,5-dimethyl-1,2,4-oxadiazole;2,5-dimethyl-1,3-oxazole;5-methyl-3-phenyl-1,2,4-oxadiazole;5-methyl-2-phenyl-1,3-oxazole;2-methyl-1,3,4,5-tetraphenylpyrrole;3-methyl-1,2,4,5-tetraphenylpyrrole;bis(1,2,3,4,5-pentamethylpyrrole);1,2,4-trimethyl-3,5-diphenylpyrrole;1,3,4-trimethyl-2,5-diphenylpyrrole;bis(2,3,5-trimethyl-1,4-diphenylpyrrole)?

The IUPAC name of 3,5-dimethyl-1,2,4-oxadiazole;2,5-dimethyl-1,3-oxazole;5-methyl-3-phenyl-1,2,4-oxadiazole;5-methyl-2-phenyl-1,3-oxazole;2-methyl-1,3,4,5-tetraphenylpyrrole;3-methyl-1,2,4,5-tetraphenylpyrrole;bis(1,2,3,4,5-pentamethylpyrrole);1,2,4-trimethyl-3,5-diphenylpyrrole;1,3,4-trimethyl-2,5-diphenylpyrrole;bis(2,3,5-trimethyl-1,4-diphenylpyrrole) (CID 158411587) is 3,5-dimethyl-1,2,4-oxadiazole;2,5-dimethyl-1,3-oxazole;5-methyl-3-phenyl-1,2,4-oxadiazole;5-methyl-2-phenyl-1,3-oxazole;2-methyl-1,3,4,5-tetraphenylpyrrole;3-methyl-1,2,4,5-tetraphenylpyrrole;bis(1,2,3,4,5-pentamethylpyrrole);1,2,4-trimethyl-3,5-diphenylpyrrole;1,3,4-trimethyl-2,5-diphenylpyrrole;bis(2,3,5-trimethyl-1,4-diphenylpyrrole).

What is the SMILES notation for 3,5-dimethyl-1,2,4-oxadiazole;2,5-dimethyl-1,3-oxazole;5-methyl-3-phenyl-1,2,4-oxadiazole;5-methyl-2-phenyl-1,3-oxazole;2-methyl-1,3,4,5-tetraphenylpyrrole;3-methyl-1,2,4,5-tetraphenylpyrrole;bis(1,2,3,4,5-pentamethylpyrrole);1,2,4-trimethyl-3,5-diphenylpyrrole;1,3,4-trimethyl-2,5-diphenylpyrrole;bis(2,3,5-trimethyl-1,4-diphenylpyrrole)?

The canonical SMILES for 3,5-dimethyl-1,2,4-oxadiazole;2,5-dimethyl-1,3-oxazole;5-methyl-3-phenyl-1,2,4-oxadiazole;5-methyl-2-phenyl-1,3-oxazole;2-methyl-1,3,4,5-tetraphenylpyrrole;3-methyl-1,2,4,5-tetraphenylpyrrole;bis(1,2,3,4,5-pentamethylpyrrole);1,2,4-trimethyl-3,5-diphenylpyrrole;1,3,4-trimethyl-2,5-diphenylpyrrole;bis(2,3,5-trimethyl-1,4-diphenylpyrrole) is Cc1c(-c2ccccc2)c(-c2ccccc2)c(-c2ccccc2)n1-c1ccccc1.Cc1c(-c2ccccc2)c(-c2ccccc2)n(-c2ccccc2)c1-c1ccccc1.Cc1c(-c2ccccc2)c(C)n(-c2ccccc2)c1C.Cc1c(-c2ccccc2)c(C)n(-c2ccccc2)c1C.Cc1c(-c2ccccc2)c(C)n(C)c1-c1ccccc1.Cc1c(C)c(-c2ccccc2)n(C)c1-c1ccccc1.Cc1c(C)c(C)n(C)c1C.Cc1c(C)c(C)n(C)c1C.Cc1cnc(-c2ccccc2)o1.Cc1cnc(C)o1.Cc1nc(-c2ccccc2)no1.Cc1noc(C)n1.

What is the InChIKey of 3,5-dimethyl-1,2,4-oxadiazole;2,5-dimethyl-1,3-oxazole;5-methyl-3-phenyl-1,2,4-oxadiazole;5-methyl-2-phenyl-1,3-oxazole;2-methyl-1,3,4,5-tetraphenylpyrrole;3-methyl-1,2,4,5-tetraphenylpyrrole;bis(1,2,3,4,5-pentamethylpyrrole);1,2,4-trimethyl-3,5-diphenylpyrrole;1,3,4-trimethyl-2,5-diphenylpyrrole;bis(2,3,5-trimethyl-1,4-diphenylpyrrole)?

The InChIKey is GZJOMBHXIIMOCR-UHFFFAOYSA-N. The full InChI is InChI=1S/2C29H23N.4C19H19N.C10H9NO.C9H8N2O.2C9H15N.C5H7NO.C4H6N2O/c1-22-27(23-14-6-2-7-15-23)28(24-16-8-3-9-17-24)29(25-18-10-4-11-19-25)30(22)26-20-12-5-13-21-26;1-22-27(23-14-6-2-7-15-23)29(25-18-10-4-11-19-25)30(26-20-12-5-13-21-26)28(22)24-16-8-3-9-17-24;1-14-18(16-10-6-4-7-11-16)15(2)20(3)19(14)17-12-8-5-9-13-17;1-14-15(2)19(17-12-8-5-9-13-17)20(3)18(14)16-10-6-4-7-11-16;2*1-14-15(2)20(18-12-8-5-9-13-18)16(3)19(14)17-10-6-4-7-11-17;1-8-7-11-10(12-8)9-5-3-2-4-6-9;1-7-10-9(11-12-7)8-5-3-2-4-6-8;2*1-6-7(2)9(4)10(5)8(6)3;1-4-3-6-5(2)7-4;1-3-5-4(2)7-6-3/h2*2-21H,1H3;4*4-13H,1-3H3;2-7H,1H3;2-6H,1H3;2*1-5H3;3H,1-2H3;1-2H3.

What are the key properties of 3,5-dimethyl-1,2,4-oxadiazole;2,5-dimethyl-1,3-oxazole;5-methyl-3-phenyl-1,2,4-oxadiazole;5-methyl-2-phenyl-1,3-oxazole;2-methyl-1,3,4,5-tetraphenylpyrrole;3-methyl-1,2,4,5-tetraphenylpyrrole;bis(1,2,3,4,5-pentamethylpyrrole);1,2,4-trimethyl-3,5-diphenylpyrrole;1,3,4-trimethyl-2,5-diphenylpyrrole;bis(2,3,5-trimethyl-1,4-diphenylpyrrole)?

3,5-dimethyl-1,2,4-oxadiazole;2,5-dimethyl-1,3-oxazole;5-methyl-3-phenyl-1,2,4-oxadiazole;5-methyl-2-phenyl-1,3-oxazole;2-methyl-1,3,4,5-tetraphenylpyrrole;3-methyl-1,2,4,5-tetraphenylpyrrole;bis(1,2,3,4,5-pentamethylpyrrole);1,2,4-trimethyl-3,5-diphenylpyrrole;1,3,4-trimethyl-2,5-diphenylpyrrole;bis(2,3,5-trimethyl-1,4-diphenylpyrrole) has a molecular weight of 2605.53 g/mol, XLogP of 46.85, 18 rotatable bonds, 0 hydrogen bond donors, and 18 hydrogen bond acceptors.

Where does this data come from?

All data for 3,5-dimethyl-1,2,4-oxadiazole;2,5-dimethyl-1,3-oxazole;5-methyl-3-phenyl-1,2,4-oxadiazole;5-methyl-2-phenyl-1,3-oxazole;2-methyl-1,3,4,5-tetraphenylpyrrole;3-methyl-1,2,4,5-tetraphenylpyrrole;bis(1,2,3,4,5-pentamethylpyrrole);1,2,4-trimethyl-3,5-diphenylpyrrole;1,3,4-trimethyl-2,5-diphenylpyrrole;bis(2,3,5-trimethyl-1,4-diphenylpyrrole) is sourced from PubChem (CID 158411587), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).