5-bromo-2-methylpyridine;2-(1,1-difluoroethyl)-5-methyl-1,3,4-thiadiazole;2,6-dimethyl-1,3-benzothiazole;bis(2,4-dimethylpyridine);5-ethynyl-2-methylpyridine;methane;5-methyl-1,3-benzodioxole;3-methyl-1,2-benzoxazole;2-methyl-4-(4-methylphenyl)-1,3-thiazole;bis(2-methylpyridine);4-methylpyridine;4-methyl-1H-pyridin-2-one;2-methylpyrimidine;4-methylpyrimidine;2-methylquinoline;4-methylthieno[3,2-c]pyridine;2-methyl-4-(trifluoromethyl)pyridine;2-methyl-4-(trifluoromethyl)pyrimidine;1,2,5-trimethylbenzimidazole

C146H159BrF8N24O4S4 — CID 158363966

About 5-bromo-2-methylpyridine;2-(1,1-difluoroethyl)-5-methyl-1,3,4-thiadiazole;2,6-dimethyl-1,3-benzothiazole;bis(2,4-dimethylpyridine);5-ethynyl-2-methylpyridine;methane;5-methyl-1,3-benzodioxole;3-methyl-1,2-benzoxazole;2-methyl-4-(4-methylphenyl)-1,3-thiazole;bis(2-methylpyridine);4-methylpyridine;4-methyl-1H-pyridin-2-one;2-methylpyrimidine;4-methylpyrimidine;2-methylquinoline;4-methylthieno[3,2-c]pyridine;2-methyl-4-(trifluoromethyl)pyridine;2-methyl-4-(trifluoromethyl)pyrimidine;1,2,5-trimethylbenzimidazole

5-bromo-2-methylpyridine;2-(1,1-difluoroethyl)-5-methyl-1,3,4-thiadiazole;2,6-dimethyl-1,3-benzothiazole;bis(2,4-dimethylpyridine);5-ethynyl-2-methylpyridine;methane;5-methyl-1,3-benzodioxole;3-methyl-1,2-benzoxazole;2-methyl-4-(4-methylphenyl)-1,3-thiazole;bis(2-methylpyridine);4-methylpyridine;4-methyl-1H-pyridin-2-one;2-methylpyrimidine;4-methylpyrimidine;2-methylquinoline;4-methylthieno[3,2-c]pyridine;2-methyl-4-(trifluoromethyl)pyridine;2-methyl-4-(trifluoromethyl)pyrimidine;1,2,5-trimethylbenzimidazole (PubChem CID 158363966) has the molecular formula C146H159BrF8N24O4S4 and a molecular weight of 2674.20 g/mol. Its IUPAC name is 5-bromo-2-methylpyridine;2-(1,1-difluoroethyl)-5-methyl-1,3,4-thiadiazole;2,6-dimethyl-1,3-benzothiazole;bis(2,4-dimethylpyridine);5-ethynyl-2-methylpyridine;methane;5-methyl-1,3-benzodioxole;3-methyl-1,2-benzoxazole;2-methyl-4-(4-methylphenyl)-1,3-thiazole;bis(2-methylpyridine);4-methylpyridine;4-methyl-1H-pyridin-2-one;2-methylpyrimidine;4-methylpyrimidine;2-methylquinoline;4-methylthieno[3,2-c]pyridine;2-methyl-4-(trifluoromethyl)pyridine;2-methyl-4-(trifluoromethyl)pyrimidine;1,2,5-trimethylbenzimidazole.

Molecular Properties

• Compound Name: 5-bromo-2-methylpyridine;2-(1,1-difluoroethyl)-5-methyl-1,3,4-thiadiazole;2,6-dimethyl-1,3-benzothiazole;bis(2,4-dimethylpyridine);5-ethynyl-2-methylpyridine;methane;5-methyl-1,3-benzodioxole;3-methyl-1,2-benzoxazole;2-methyl-4-(4-methylphenyl)-1,3-thiazole;bis(2-methylpyridine);4-methylpyridine;4-methyl-1H-pyridin-2-one;2-methylpyrimidine;4-methylpyrimidine;2-methylquinoline;4-methylthieno[3,2-c]pyridine;2-methyl-4-(trifluoromethyl)pyridine;2-methyl-4-(trifluoromethyl)pyrimidine;1,2,5-trimethylbenzimidazole
• PubChem CID: 158363966
• Molecular Formula: C146H159BrF8N24O4S4
• Molecular Weight: 2674.20 g/mol
• Exact Mass: 2671.09
• IUPAC Name: 5-bromo-2-methylpyridine;2-(1,1-difluoroethyl)-5-methyl-1,3,4-thiadiazole;2,6-dimethyl-1,3-benzothiazole;bis(2,4-dimethylpyridine);5-ethynyl-2-methylpyridine;methane;5-methyl-1,3-benzodioxole;3-methyl-1,2-benzoxazole;2-methyl-4-(4-methylphenyl)-1,3-thiazole;bis(2-methylpyridine);4-methylpyridine;4-methyl-1H-pyridin-2-one;2-methylpyrimidine;4-methylpyrimidine;2-methylquinoline;4-methylthieno[3,2-c]pyridine;2-methyl-4-(trifluoromethyl)pyridine;2-methyl-4-(trifluoromethyl)pyrimidine;1,2,5-trimethylbenzimidazole
• SMILES: C.C.C#Cc1ccc(C)nc1.Cc1cc(C(F)(F)F)ccn1.Cc1cc[nH]c(=O)c1.Cc1ccc(-c2csc(C)n2)cc1.Cc1ccc(Br)cn1.Cc1ccc2c(c1)OCO2.Cc1ccc2c(c1)nc(C)n2C.Cc1ccc2ccccc2n1.Cc1ccc2nc(C)sc2c1.Cc1ccccn1.Cc1ccccn1.Cc1ccnc(C)c1.Cc1ccnc(C)c1.Cc1ccncc1.Cc1ccncn1.Cc1nccc(C(F)(F)F)n1.Cc1nccc2sccc12.Cc1ncccn1.Cc1nnc(C(C)(F)F)s1.Cc1noc2ccccc12
• InChI: InChI=1S/C11H11NS.C10H12N2.C10H9N.C9H9NS.C8H7NO.C8H7NS.C8H7N.C8H8O2.C7H6F3N.2C7H9N.C6H6BrN.C6H5F3N2.C6H7NO.3C6H7N.C5H6F2N2S.2C5H6N2.2CH4/c1-8-3-5-10(6-4-8)11-7-13-9(2)12-11;1-7-4-5-10-9(6-7)11-8(2)12(10)3;1-8-6-7-9-4-2-3-5-10(9)11-8;1-6-3-4-8-9(5-6)11-7(2)10-8;1-6-7-4-2-3-5-8(7)10-9-6;1-6-7-3-5-10-8(7)2-4-9-6;1-3-8-5-4-7(2)9-6-8;1-6-2-3-7-8(4-6)10-5-9-7;1-5-4-6(2-3-11-5)7(8,9)10;2*1-6-3-4-8-7(2)5-6;1-5-2-3-6(7)4-8-5;1-4-10-3-2-5(11-4)6(7,8)9;1-5-2-3-7-6(8)4-5;1-6-2-4-7-5-3-6;2*1-6-4-2-3-5-7-6;1-3-8-9-4(10-3)5(2,6)7;1-5-2-3-6-4-7-5;1-5-6-3-2-4-7-5;;/h3-7H,1-2H3;4-6H,1-3H3;2-7H,1H3;3-5H,1-2H3;2*2-5H,1H3;1,4-6H,2H3;2-4H,5H2,1H3;2-4H,1H3;2*3-5H,1-2H3;2-4H,1H3;2-3H,1H3;2-4H,1H3,(H,7,8);3*2-5H,1H3;1-2H3;2*2-4H,1H3;2*1H4
• InChIKey: GTUMBQMEOPQGLD-UHFFFAOYSA-N
• XLogP: 38.33
• TPSA: 352.97 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 31
• Rotatable Bonds: 2
• Heavy Atoms: 187
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2674.20
LogP ≤ 5	38.33
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	31

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 5-bromo-2-methylpyridine;2-(1,1-difluoroethyl)-5-methyl-1,3,4-thiadiazole;2,6-dimethyl-1,3-benzothiazole;bis(2,4-dimethylpyridine);5-ethynyl-2-methylpyridine;methane;5-methyl-1,3-benzodioxole;3-methyl-1,2-benzoxazole;2-methyl-4-(4-methylphenyl)-1,3-thiazole;bis(2-methylpyridine);4-methylpyridine;4-methyl-1H-pyridin-2-one;2-methylpyrimidine;4-methylpyrimidine;2-methylquinoline;4-methylthieno[3,2-c]pyridine;2-methyl-4-(trifluoromethyl)pyridine;2-methyl-4-(trifluoromethyl)pyrimidine;1,2,5-trimethylbenzimidazole?

The IUPAC name of 5-bromo-2-methylpyridine;2-(1,1-difluoroethyl)-5-methyl-1,3,4-thiadiazole;2,6-dimethyl-1,3-benzothiazole;bis(2,4-dimethylpyridine);5-ethynyl-2-methylpyridine;methane;5-methyl-1,3-benzodioxole;3-methyl-1,2-benzoxazole;2-methyl-4-(4-methylphenyl)-1,3-thiazole;bis(2-methylpyridine);4-methylpyridine;4-methyl-1H-pyridin-2-one;2-methylpyrimidine;4-methylpyrimidine;2-methylquinoline;4-methylthieno[3,2-c]pyridine;2-methyl-4-(trifluoromethyl)pyridine;2-methyl-4-(trifluoromethyl)pyrimidine;1,2,5-trimethylbenzimidazole (CID 158363966) is 5-bromo-2-methylpyridine;2-(1,1-difluoroethyl)-5-methyl-1,3,4-thiadiazole;2,6-dimethyl-1,3-benzothiazole;bis(2,4-dimethylpyridine);5-ethynyl-2-methylpyridine;methane;5-methyl-1,3-benzodioxole;3-methyl-1,2-benzoxazole;2-methyl-4-(4-methylphenyl)-1,3-thiazole;bis(2-methylpyridine);4-methylpyridine;4-methyl-1H-pyridin-2-one;2-methylpyrimidine;4-methylpyrimidine;2-methylquinoline;4-methylthieno[3,2-c]pyridine;2-methyl-4-(trifluoromethyl)pyridine;2-methyl-4-(trifluoromethyl)pyrimidine;1,2,5-trimethylbenzimidazole.

What is the SMILES notation for 5-bromo-2-methylpyridine;2-(1,1-difluoroethyl)-5-methyl-1,3,4-thiadiazole;2,6-dimethyl-1,3-benzothiazole;bis(2,4-dimethylpyridine);5-ethynyl-2-methylpyridine;methane;5-methyl-1,3-benzodioxole;3-methyl-1,2-benzoxazole;2-methyl-4-(4-methylphenyl)-1,3-thiazole;bis(2-methylpyridine);4-methylpyridine;4-methyl-1H-pyridin-2-one;2-methylpyrimidine;4-methylpyrimidine;2-methylquinoline;4-methylthieno[3,2-c]pyridine;2-methyl-4-(trifluoromethyl)pyridine;2-methyl-4-(trifluoromethyl)pyrimidine;1,2,5-trimethylbenzimidazole?

The canonical SMILES for 5-bromo-2-methylpyridine;2-(1,1-difluoroethyl)-5-methyl-1,3,4-thiadiazole;2,6-dimethyl-1,3-benzothiazole;bis(2,4-dimethylpyridine);5-ethynyl-2-methylpyridine;methane;5-methyl-1,3-benzodioxole;3-methyl-1,2-benzoxazole;2-methyl-4-(4-methylphenyl)-1,3-thiazole;bis(2-methylpyridine);4-methylpyridine;4-methyl-1H-pyridin-2-one;2-methylpyrimidine;4-methylpyrimidine;2-methylquinoline;4-methylthieno[3,2-c]pyridine;2-methyl-4-(trifluoromethyl)pyridine;2-methyl-4-(trifluoromethyl)pyrimidine;1,2,5-trimethylbenzimidazole is C.C.C#Cc1ccc(C)nc1.Cc1cc(C(F)(F)F)ccn1.Cc1cc[nH]c(=O)c1.Cc1ccc(-c2csc(C)n2)cc1.Cc1ccc(Br)cn1.Cc1ccc2c(c1)OCO2.Cc1ccc2c(c1)nc(C)n2C.Cc1ccc2ccccc2n1.Cc1ccc2nc(C)sc2c1.Cc1ccccn1.Cc1ccccn1.Cc1ccnc(C)c1.Cc1ccnc(C)c1.Cc1ccncc1.Cc1ccncn1.Cc1nccc(C(F)(F)F)n1.Cc1nccc2sccc12.Cc1ncccn1.Cc1nnc(C(C)(F)F)s1.Cc1noc2ccccc12.

What is the InChIKey of 5-bromo-2-methylpyridine;2-(1,1-difluoroethyl)-5-methyl-1,3,4-thiadiazole;2,6-dimethyl-1,3-benzothiazole;bis(2,4-dimethylpyridine);5-ethynyl-2-methylpyridine;methane;5-methyl-1,3-benzodioxole;3-methyl-1,2-benzoxazole;2-methyl-4-(4-methylphenyl)-1,3-thiazole;bis(2-methylpyridine);4-methylpyridine;4-methyl-1H-pyridin-2-one;2-methylpyrimidine;4-methylpyrimidine;2-methylquinoline;4-methylthieno[3,2-c]pyridine;2-methyl-4-(trifluoromethyl)pyridine;2-methyl-4-(trifluoromethyl)pyrimidine;1,2,5-trimethylbenzimidazole?

The InChIKey is GTUMBQMEOPQGLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11NS.C10H12N2.C10H9N.C9H9NS.C8H7NO.C8H7NS.C8H7N.C8H8O2.C7H6F3N.2C7H9N.C6H6BrN.C6H5F3N2.C6H7NO.3C6H7N.C5H6F2N2S.2C5H6N2.2CH4/c1-8-3-5-10(6-4-8)11-7-13-9(2)12-11;1-7-4-5-10-9(6-7)11-8(2)12(10)3;1-8-6-7-9-4-2-3-5-10(9)11-8;1-6-3-4-8-9(5-6)11-7(2)10-8;1-6-7-4-2-3-5-8(7)10-9-6;1-6-7-3-5-10-8(7)2-4-9-6;1-3-8-5-4-7(2)9-6-8;1-6-2-3-7-8(4-6)10-5-9-7;1-5-4-6(2-3-11-5)7(8,9)10;2*1-6-3-4-8-7(2)5-6;1-5-2-3-6(7)4-8-5;1-4-10-3-2-5(11-4)6(7,8)9;1-5-2-3-7-6(8)4-5;1-6-2-4-7-5-3-6;2*1-6-4-2-3-5-7-6;1-3-8-9-4(10-3)5(2,6)7;1-5-2-3-6-4-7-5;1-5-6-3-2-4-7-5;;/h3-7H,1-2H3;4-6H,1-3H3;2-7H,1H3;3-5H,1-2H3;2*2-5H,1H3;1,4-6H,2H3;2-4H,5H2,1H3;2-4H,1H3;2*3-5H,1-2H3;2-4H,1H3;2-3H,1H3;2-4H,1H3,(H,7,8);3*2-5H,1H3;1-2H3;2*2-4H,1H3;2*1H4.

What are the key properties of 5-bromo-2-methylpyridine;2-(1,1-difluoroethyl)-5-methyl-1,3,4-thiadiazole;2,6-dimethyl-1,3-benzothiazole;bis(2,4-dimethylpyridine);5-ethynyl-2-methylpyridine;methane;5-methyl-1,3-benzodioxole;3-methyl-1,2-benzoxazole;2-methyl-4-(4-methylphenyl)-1,3-thiazole;bis(2-methylpyridine);4-methylpyridine;4-methyl-1H-pyridin-2-one;2-methylpyrimidine;4-methylpyrimidine;2-methylquinoline;4-methylthieno[3,2-c]pyridine;2-methyl-4-(trifluoromethyl)pyridine;2-methyl-4-(trifluoromethyl)pyrimidine;1,2,5-trimethylbenzimidazole?

5-bromo-2-methylpyridine;2-(1,1-difluoroethyl)-5-methyl-1,3,4-thiadiazole;2,6-dimethyl-1,3-benzothiazole;bis(2,4-dimethylpyridine);5-ethynyl-2-methylpyridine;methane;5-methyl-1,3-benzodioxole;3-methyl-1,2-benzoxazole;2-methyl-4-(4-methylphenyl)-1,3-thiazole;bis(2-methylpyridine);4-methylpyridine;4-methyl-1H-pyridin-2-one;2-methylpyrimidine;4-methylpyrimidine;2-methylquinoline;4-methylthieno[3,2-c]pyridine;2-methyl-4-(trifluoromethyl)pyridine;2-methyl-4-(trifluoromethyl)pyrimidine;1,2,5-trimethylbenzimidazole has a molecular weight of 2674.20 g/mol, XLogP of 38.33, 2 rotatable bonds, 1 hydrogen bond donors, and 31 hydrogen bond acceptors.

Where does this data come from?

All data for 5-bromo-2-methylpyridine;2-(1,1-difluoroethyl)-5-methyl-1,3,4-thiadiazole;2,6-dimethyl-1,3-benzothiazole;bis(2,4-dimethylpyridine);5-ethynyl-2-methylpyridine;methane;5-methyl-1,3-benzodioxole;3-methyl-1,2-benzoxazole;2-methyl-4-(4-methylphenyl)-1,3-thiazole;bis(2-methylpyridine);4-methylpyridine;4-methyl-1H-pyridin-2-one;2-methylpyrimidine;4-methylpyrimidine;2-methylquinoline;4-methylthieno[3,2-c]pyridine;2-methyl-4-(trifluoromethyl)pyridine;2-methyl-4-(trifluoromethyl)pyrimidine;1,2,5-trimethylbenzimidazole is sourced from PubChem (CID 158363966), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).