2,5-di(propan-2-yl)thiophene;5-(4-methylphenyl)-3-propan-2-yl-1,2,4-oxadiazole;2-methyl-5-propan-2-ylthiophene;4-methyl-3-propan-2-yl-1H-1,2,4-triazole-5-thione;2-methyl-5-(5-propan-2-yl-1H-1,2,4-triazol-3-yl)pyridine;5-(6-methyl-3-pyridinyl)-3-propan-2-yl-1,2,4-oxadiazole;5-(6-methyl-3-pyridinyl)-2-propan-2-yl-1,3-thiazole;5-phenyl-3-propan-2-yl-1,2,4-oxadiazole;4-phenyl-2-propan-2-yl-1,3-thiazole;5-phenyl-2-propan-2-yl-1,3-thiazole;3-phenyl-5-propan-2-yl-1H-1,2,4-triazole;3-propan-2-yl-5-pyridin-4-yl-1,2,4-oxadiazole;2-propan-2-yl-5-pyridin-4-yl-1,3-thiazole;2-propan-2-ylthiophene;4-(5-propan-2-yl-1H-1,2,4-triazol-3-yl)pyridine

C154H190N30O4S8 — CID 159485107

About 2,5-di(propan-2-yl)thiophene;5-(4-methylphenyl)-3-propan-2-yl-1,2,4-oxadiazole;2-methyl-5-propan-2-ylthiophene;4-methyl-3-propan-2-yl-1H-1,2,4-triazole-5-thione;2-methyl-5-(5-propan-2-yl-1H-1,2,4-triazol-3-yl)pyridine;5-(6-methyl-3-pyridinyl)-3-propan-2-yl-1,2,4-oxadiazole;5-(6-methyl-3-pyridinyl)-2-propan-2-yl-1,3-thiazole;5-phenyl-3-propan-2-yl-1,2,4-oxadiazole;4-phenyl-2-propan-2-yl-1,3-thiazole;5-phenyl-2-propan-2-yl-1,3-thiazole;3-phenyl-5-propan-2-yl-1H-1,2,4-triazole;3-propan-2-yl-5-pyridin-4-yl-1,2,4-oxadiazole;2-propan-2-yl-5-pyridin-4-yl-1,3-thiazole;2-propan-2-ylthiophene;4-(5-propan-2-yl-1H-1,2,4-triazol-3-yl)pyridine

2,5-di(propan-2-yl)thiophene;5-(4-methylphenyl)-3-propan-2-yl-1,2,4-oxadiazole;2-methyl-5-propan-2-ylthiophene;4-methyl-3-propan-2-yl-1H-1,2,4-triazole-5-thione;2-methyl-5-(5-propan-2-yl-1H-1,2,4-triazol-3-yl)pyridine;5-(6-methyl-3-pyridinyl)-3-propan-2-yl-1,2,4-oxadiazole;5-(6-methyl-3-pyridinyl)-2-propan-2-yl-1,3-thiazole;5-phenyl-3-propan-2-yl-1,2,4-oxadiazole;4-phenyl-2-propan-2-yl-1,3-thiazole;5-phenyl-2-propan-2-yl-1,3-thiazole;3-phenyl-5-propan-2-yl-1H-1,2,4-triazole;3-propan-2-yl-5-pyridin-4-yl-1,2,4-oxadiazole;2-propan-2-yl-5-pyridin-4-yl-1,3-thiazole;2-propan-2-ylthiophene;4-(5-propan-2-yl-1H-1,2,4-triazol-3-yl)pyridine (PubChem CID 159485107) has the molecular formula C154H190N30O4S8 and a molecular weight of 2781.96 g/mol. Its IUPAC name is 2,5-di(propan-2-yl)thiophene;5-(4-methylphenyl)-3-propan-2-yl-1,2,4-oxadiazole;2-methyl-5-propan-2-ylthiophene;4-methyl-3-propan-2-yl-1H-1,2,4-triazole-5-thione;2-methyl-5-(5-propan-2-yl-1H-1,2,4-triazol-3-yl)pyridine;5-(6-methyl-3-pyridinyl)-3-propan-2-yl-1,2,4-oxadiazole;5-(6-methyl-3-pyridinyl)-2-propan-2-yl-1,3-thiazole;5-phenyl-3-propan-2-yl-1,2,4-oxadiazole;4-phenyl-2-propan-2-yl-1,3-thiazole;5-phenyl-2-propan-2-yl-1,3-thiazole;3-phenyl-5-propan-2-yl-1H-1,2,4-triazole;3-propan-2-yl-5-pyridin-4-yl-1,2,4-oxadiazole;2-propan-2-yl-5-pyridin-4-yl-1,3-thiazole;2-propan-2-ylthiophene;4-(5-propan-2-yl-1H-1,2,4-triazol-3-yl)pyridine.

Molecular Properties

• Compound Name: 2,5-di(propan-2-yl)thiophene;5-(4-methylphenyl)-3-propan-2-yl-1,2,4-oxadiazole;2-methyl-5-propan-2-ylthiophene;4-methyl-3-propan-2-yl-1H-1,2,4-triazole-5-thione;2-methyl-5-(5-propan-2-yl-1H-1,2,4-triazol-3-yl)pyridine;5-(6-methyl-3-pyridinyl)-3-propan-2-yl-1,2,4-oxadiazole;5-(6-methyl-3-pyridinyl)-2-propan-2-yl-1,3-thiazole;5-phenyl-3-propan-2-yl-1,2,4-oxadiazole;4-phenyl-2-propan-2-yl-1,3-thiazole;5-phenyl-2-propan-2-yl-1,3-thiazole;3-phenyl-5-propan-2-yl-1H-1,2,4-triazole;3-propan-2-yl-5-pyridin-4-yl-1,2,4-oxadiazole;2-propan-2-yl-5-pyridin-4-yl-1,3-thiazole;2-propan-2-ylthiophene;4-(5-propan-2-yl-1H-1,2,4-triazol-3-yl)pyridine
• PubChem CID: 159485107
• Molecular Formula: C154H190N30O4S8
• Molecular Weight: 2781.96 g/mol
• Exact Mass: 2779.34
• IUPAC Name: 2,5-di(propan-2-yl)thiophene;5-(4-methylphenyl)-3-propan-2-yl-1,2,4-oxadiazole;2-methyl-5-propan-2-ylthiophene;4-methyl-3-propan-2-yl-1H-1,2,4-triazole-5-thione;2-methyl-5-(5-propan-2-yl-1H-1,2,4-triazol-3-yl)pyridine;5-(6-methyl-3-pyridinyl)-3-propan-2-yl-1,2,4-oxadiazole;5-(6-methyl-3-pyridinyl)-2-propan-2-yl-1,3-thiazole;5-phenyl-3-propan-2-yl-1,2,4-oxadiazole;4-phenyl-2-propan-2-yl-1,3-thiazole;5-phenyl-2-propan-2-yl-1,3-thiazole;3-phenyl-5-propan-2-yl-1H-1,2,4-triazole;3-propan-2-yl-5-pyridin-4-yl-1,2,4-oxadiazole;2-propan-2-yl-5-pyridin-4-yl-1,3-thiazole;2-propan-2-ylthiophene;4-(5-propan-2-yl-1H-1,2,4-triazol-3-yl)pyridine
• SMILES: CC(C)c1ccc(C(C)C)s1.CC(C)c1cccs1.CC(C)c1n[nH]c(=S)n1C.CC(C)c1nc(-c2ccccc2)cs1.CC(C)c1nc(-c2ccccc2)n[nH]1.CC(C)c1nc(-c2ccncc2)n[nH]1.CC(C)c1ncc(-c2ccccc2)s1.CC(C)c1ncc(-c2ccncc2)s1.CC(C)c1noc(-c2ccccc2)n1.CC(C)c1noc(-c2ccncc2)n1.Cc1ccc(-c2cnc(C(C)C)s2)cn1.Cc1ccc(-c2n[nH]c(C(C)C)n2)cn1.Cc1ccc(-c2nc(C(C)C)no2)cc1.Cc1ccc(-c2nc(C(C)C)no2)cn1.Cc1ccc(C(C)C)s1
• InChI: InChI=1S/C12H14N2O.C12H14N2S.2C12H13NS.C11H14N4.C11H13N3O.C11H13N3.C11H12N2O.C11H12N2S.C10H12N4.C10H11N3O.C10H16S.C8H12S.C7H10S.C6H11N3S/c1-8(2)11-13-12(15-14-11)10-6-4-9(3)5-7-10;1-8(2)12-14-7-11(15-12)10-5-4-9(3)13-6-10;1-9(2)12-13-11(8-14-12)10-6-4-3-5-7-10;1-9(2)12-13-8-11(14-12)10-6-4-3-5-7-10;2*1-7(2)10-13-11(15-14-10)9-5-4-8(3)12-6-9;2*1-8(2)10-12-11(14-13-10)9-6-4-3-5-7-9;1-8(2)11-13-7-10(14-11)9-3-5-12-6-4-9;2*1-7(2)9-12-10(14-13-9)8-3-5-11-6-4-8;1-7(2)9-5-6-10(11-9)8(3)4;1-6(2)8-5-4-7(3)9-8;1-6(2)7-4-3-5-8-7;1-4(2)5-7-8-6(10)9(5)3/h2*4-8H,1-3H3;2*3-9H,1-2H3;4-7H,1-3H3,(H,13,14,15);4-7H,1-3H3;3-8H,1-2H3,(H,12,13,14);2*3-8H,1-2H3;3-7H,1-2H3,(H,12,13,14);3-7H,1-2H3;5-8H,1-4H3;4-6H,1-3H3;3-6H,1-2H3;4H,1-3H3,(H,8,10)
• InChIKey: LXMDPNZOQFWJDL-UHFFFAOYSA-N
• XLogP: 44.21
• TPSA: 442.90 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 38
• Rotatable Bonds: 27
• Heavy Atoms: 196
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2781.96
LogP ≤ 5	44.21
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	38

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2,5-di(propan-2-yl)thiophene;5-(4-methylphenyl)-3-propan-2-yl-1,2,4-oxadiazole;2-methyl-5-propan-2-ylthiophene;4-methyl-3-propan-2-yl-1H-1,2,4-triazole-5-thione;2-methyl-5-(5-propan-2-yl-1H-1,2,4-triazol-3-yl)pyridine;5-(6-methyl-3-pyridinyl)-3-propan-2-yl-1,2,4-oxadiazole;5-(6-methyl-3-pyridinyl)-2-propan-2-yl-1,3-thiazole;5-phenyl-3-propan-2-yl-1,2,4-oxadiazole;4-phenyl-2-propan-2-yl-1,3-thiazole;5-phenyl-2-propan-2-yl-1,3-thiazole;3-phenyl-5-propan-2-yl-1H-1,2,4-triazole;3-propan-2-yl-5-pyridin-4-yl-1,2,4-oxadiazole;2-propan-2-yl-5-pyridin-4-yl-1,3-thiazole;2-propan-2-ylthiophene;4-(5-propan-2-yl-1H-1,2,4-triazol-3-yl)pyridine?

The IUPAC name of 2,5-di(propan-2-yl)thiophene;5-(4-methylphenyl)-3-propan-2-yl-1,2,4-oxadiazole;2-methyl-5-propan-2-ylthiophene;4-methyl-3-propan-2-yl-1H-1,2,4-triazole-5-thione;2-methyl-5-(5-propan-2-yl-1H-1,2,4-triazol-3-yl)pyridine;5-(6-methyl-3-pyridinyl)-3-propan-2-yl-1,2,4-oxadiazole;5-(6-methyl-3-pyridinyl)-2-propan-2-yl-1,3-thiazole;5-phenyl-3-propan-2-yl-1,2,4-oxadiazole;4-phenyl-2-propan-2-yl-1,3-thiazole;5-phenyl-2-propan-2-yl-1,3-thiazole;3-phenyl-5-propan-2-yl-1H-1,2,4-triazole;3-propan-2-yl-5-pyridin-4-yl-1,2,4-oxadiazole;2-propan-2-yl-5-pyridin-4-yl-1,3-thiazole;2-propan-2-ylthiophene;4-(5-propan-2-yl-1H-1,2,4-triazol-3-yl)pyridine (CID 159485107) is 2,5-di(propan-2-yl)thiophene;5-(4-methylphenyl)-3-propan-2-yl-1,2,4-oxadiazole;2-methyl-5-propan-2-ylthiophene;4-methyl-3-propan-2-yl-1H-1,2,4-triazole-5-thione;2-methyl-5-(5-propan-2-yl-1H-1,2,4-triazol-3-yl)pyridine;5-(6-methyl-3-pyridinyl)-3-propan-2-yl-1,2,4-oxadiazole;5-(6-methyl-3-pyridinyl)-2-propan-2-yl-1,3-thiazole;5-phenyl-3-propan-2-yl-1,2,4-oxadiazole;4-phenyl-2-propan-2-yl-1,3-thiazole;5-phenyl-2-propan-2-yl-1,3-thiazole;3-phenyl-5-propan-2-yl-1H-1,2,4-triazole;3-propan-2-yl-5-pyridin-4-yl-1,2,4-oxadiazole;2-propan-2-yl-5-pyridin-4-yl-1,3-thiazole;2-propan-2-ylthiophene;4-(5-propan-2-yl-1H-1,2,4-triazol-3-yl)pyridine.

What is the SMILES notation for 2,5-di(propan-2-yl)thiophene;5-(4-methylphenyl)-3-propan-2-yl-1,2,4-oxadiazole;2-methyl-5-propan-2-ylthiophene;4-methyl-3-propan-2-yl-1H-1,2,4-triazole-5-thione;2-methyl-5-(5-propan-2-yl-1H-1,2,4-triazol-3-yl)pyridine;5-(6-methyl-3-pyridinyl)-3-propan-2-yl-1,2,4-oxadiazole;5-(6-methyl-3-pyridinyl)-2-propan-2-yl-1,3-thiazole;5-phenyl-3-propan-2-yl-1,2,4-oxadiazole;4-phenyl-2-propan-2-yl-1,3-thiazole;5-phenyl-2-propan-2-yl-1,3-thiazole;3-phenyl-5-propan-2-yl-1H-1,2,4-triazole;3-propan-2-yl-5-pyridin-4-yl-1,2,4-oxadiazole;2-propan-2-yl-5-pyridin-4-yl-1,3-thiazole;2-propan-2-ylthiophene;4-(5-propan-2-yl-1H-1,2,4-triazol-3-yl)pyridine?

The canonical SMILES for 2,5-di(propan-2-yl)thiophene;5-(4-methylphenyl)-3-propan-2-yl-1,2,4-oxadiazole;2-methyl-5-propan-2-ylthiophene;4-methyl-3-propan-2-yl-1H-1,2,4-triazole-5-thione;2-methyl-5-(5-propan-2-yl-1H-1,2,4-triazol-3-yl)pyridine;5-(6-methyl-3-pyridinyl)-3-propan-2-yl-1,2,4-oxadiazole;5-(6-methyl-3-pyridinyl)-2-propan-2-yl-1,3-thiazole;5-phenyl-3-propan-2-yl-1,2,4-oxadiazole;4-phenyl-2-propan-2-yl-1,3-thiazole;5-phenyl-2-propan-2-yl-1,3-thiazole;3-phenyl-5-propan-2-yl-1H-1,2,4-triazole;3-propan-2-yl-5-pyridin-4-yl-1,2,4-oxadiazole;2-propan-2-yl-5-pyridin-4-yl-1,3-thiazole;2-propan-2-ylthiophene;4-(5-propan-2-yl-1H-1,2,4-triazol-3-yl)pyridine is CC(C)c1ccc(C(C)C)s1.CC(C)c1cccs1.CC(C)c1n[nH]c(=S)n1C.CC(C)c1nc(-c2ccccc2)cs1.CC(C)c1nc(-c2ccccc2)n[nH]1.CC(C)c1nc(-c2ccncc2)n[nH]1.CC(C)c1ncc(-c2ccccc2)s1.CC(C)c1ncc(-c2ccncc2)s1.CC(C)c1noc(-c2ccccc2)n1.CC(C)c1noc(-c2ccncc2)n1.Cc1ccc(-c2cnc(C(C)C)s2)cn1.Cc1ccc(-c2n[nH]c(C(C)C)n2)cn1.Cc1ccc(-c2nc(C(C)C)no2)cc1.Cc1ccc(-c2nc(C(C)C)no2)cn1.Cc1ccc(C(C)C)s1.

What is the InChIKey of 2,5-di(propan-2-yl)thiophene;5-(4-methylphenyl)-3-propan-2-yl-1,2,4-oxadiazole;2-methyl-5-propan-2-ylthiophene;4-methyl-3-propan-2-yl-1H-1,2,4-triazole-5-thione;2-methyl-5-(5-propan-2-yl-1H-1,2,4-triazol-3-yl)pyridine;5-(6-methyl-3-pyridinyl)-3-propan-2-yl-1,2,4-oxadiazole;5-(6-methyl-3-pyridinyl)-2-propan-2-yl-1,3-thiazole;5-phenyl-3-propan-2-yl-1,2,4-oxadiazole;4-phenyl-2-propan-2-yl-1,3-thiazole;5-phenyl-2-propan-2-yl-1,3-thiazole;3-phenyl-5-propan-2-yl-1H-1,2,4-triazole;3-propan-2-yl-5-pyridin-4-yl-1,2,4-oxadiazole;2-propan-2-yl-5-pyridin-4-yl-1,3-thiazole;2-propan-2-ylthiophene;4-(5-propan-2-yl-1H-1,2,4-triazol-3-yl)pyridine?

The InChIKey is LXMDPNZOQFWJDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2O.C12H14N2S.2C12H13NS.C11H14N4.C11H13N3O.C11H13N3.C11H12N2O.C11H12N2S.C10H12N4.C10H11N3O.C10H16S.C8H12S.C7H10S.C6H11N3S/c1-8(2)11-13-12(15-14-11)10-6-4-9(3)5-7-10;1-8(2)12-14-7-11(15-12)10-5-4-9(3)13-6-10;1-9(2)12-13-11(8-14-12)10-6-4-3-5-7-10;1-9(2)12-13-8-11(14-12)10-6-4-3-5-7-10;2*1-7(2)10-13-11(15-14-10)9-5-4-8(3)12-6-9;2*1-8(2)10-12-11(14-13-10)9-6-4-3-5-7-9;1-8(2)11-13-7-10(14-11)9-3-5-12-6-4-9;2*1-7(2)9-12-10(14-13-9)8-3-5-11-6-4-8;1-7(2)9-5-6-10(11-9)8(3)4;1-6(2)8-5-4-7(3)9-8;1-6(2)7-4-3-5-8-7;1-4(2)5-7-8-6(10)9(5)3/h2*4-8H,1-3H3;2*3-9H,1-2H3;4-7H,1-3H3,(H,13,14,15);4-7H,1-3H3;3-8H,1-2H3,(H,12,13,14);2*3-8H,1-2H3;3-7H,1-2H3,(H,12,13,14);3-7H,1-2H3;5-8H,1-4H3;4-6H,1-3H3;3-6H,1-2H3;4H,1-3H3,(H,8,10).

What are the key properties of 2,5-di(propan-2-yl)thiophene;5-(4-methylphenyl)-3-propan-2-yl-1,2,4-oxadiazole;2-methyl-5-propan-2-ylthiophene;4-methyl-3-propan-2-yl-1H-1,2,4-triazole-5-thione;2-methyl-5-(5-propan-2-yl-1H-1,2,4-triazol-3-yl)pyridine;5-(6-methyl-3-pyridinyl)-3-propan-2-yl-1,2,4-oxadiazole;5-(6-methyl-3-pyridinyl)-2-propan-2-yl-1,3-thiazole;5-phenyl-3-propan-2-yl-1,2,4-oxadiazole;4-phenyl-2-propan-2-yl-1,3-thiazole;5-phenyl-2-propan-2-yl-1,3-thiazole;3-phenyl-5-propan-2-yl-1H-1,2,4-triazole;3-propan-2-yl-5-pyridin-4-yl-1,2,4-oxadiazole;2-propan-2-yl-5-pyridin-4-yl-1,3-thiazole;2-propan-2-ylthiophene;4-(5-propan-2-yl-1H-1,2,4-triazol-3-yl)pyridine?

2,5-di(propan-2-yl)thiophene;5-(4-methylphenyl)-3-propan-2-yl-1,2,4-oxadiazole;2-methyl-5-propan-2-ylthiophene;4-methyl-3-propan-2-yl-1H-1,2,4-triazole-5-thione;2-methyl-5-(5-propan-2-yl-1H-1,2,4-triazol-3-yl)pyridine;5-(6-methyl-3-pyridinyl)-3-propan-2-yl-1,2,4-oxadiazole;5-(6-methyl-3-pyridinyl)-2-propan-2-yl-1,3-thiazole;5-phenyl-3-propan-2-yl-1,2,4-oxadiazole;4-phenyl-2-propan-2-yl-1,3-thiazole;5-phenyl-2-propan-2-yl-1,3-thiazole;3-phenyl-5-propan-2-yl-1H-1,2,4-triazole;3-propan-2-yl-5-pyridin-4-yl-1,2,4-oxadiazole;2-propan-2-yl-5-pyridin-4-yl-1,3-thiazole;2-propan-2-ylthiophene;4-(5-propan-2-yl-1H-1,2,4-triazol-3-yl)pyridine has a molecular weight of 2781.96 g/mol, XLogP of 44.21, 27 rotatable bonds, 4 hydrogen bond donors, and 38 hydrogen bond acceptors.

Where does this data come from?

All data for 2,5-di(propan-2-yl)thiophene;5-(4-methylphenyl)-3-propan-2-yl-1,2,4-oxadiazole;2-methyl-5-propan-2-ylthiophene;4-methyl-3-propan-2-yl-1H-1,2,4-triazole-5-thione;2-methyl-5-(5-propan-2-yl-1H-1,2,4-triazol-3-yl)pyridine;5-(6-methyl-3-pyridinyl)-3-propan-2-yl-1,2,4-oxadiazole;5-(6-methyl-3-pyridinyl)-2-propan-2-yl-1,3-thiazole;5-phenyl-3-propan-2-yl-1,2,4-oxadiazole;4-phenyl-2-propan-2-yl-1,3-thiazole;5-phenyl-2-propan-2-yl-1,3-thiazole;3-phenyl-5-propan-2-yl-1H-1,2,4-triazole;3-propan-2-yl-5-pyridin-4-yl-1,2,4-oxadiazole;2-propan-2-yl-5-pyridin-4-yl-1,3-thiazole;2-propan-2-ylthiophene;4-(5-propan-2-yl-1H-1,2,4-triazol-3-yl)pyridine is sourced from PubChem (CID 159485107), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).