4-(4-cyclopropyl-5-methylsulfanyl-1,2,4-triazol-3-yl)pyridine;4-(4-cyclopropyl-5-methyl-1,2,4-triazol-3-yl)pyridine;4-(4,5-dimethyl-1,2,4-triazol-3-yl)pyridine;4-ethyl-3-(furan-2-yl)-5-methyl-1,2,4-triazole;bis(4-(4-ethyl-5-methyl-1,2,4-triazol-3-yl)pyridine);4-(4-ethyl-1,2,4-triazol-3-yl)pyridine

C69H79N27OS — CID 159282950

About 4-(4-cyclopropyl-5-methylsulfanyl-1,2,4-triazol-3-yl)pyridine;4-(4-cyclopropyl-5-methyl-1,2,4-triazol-3-yl)pyridine;4-(4,5-dimethyl-1,2,4-triazol-3-yl)pyridine;4-ethyl-3-(furan-2-yl)-5-methyl-1,2,4-triazole;bis(4-(4-ethyl-5-methyl-1,2,4-triazol-3-yl)pyridine);4-(4-ethyl-1,2,4-triazol-3-yl)pyridine

4-(4-cyclopropyl-5-methylsulfanyl-1,2,4-triazol-3-yl)pyridine;4-(4-cyclopropyl-5-methyl-1,2,4-triazol-3-yl)pyridine;4-(4,5-dimethyl-1,2,4-triazol-3-yl)pyridine;4-ethyl-3-(furan-2-yl)-5-methyl-1,2,4-triazole;bis(4-(4-ethyl-5-methyl-1,2,4-triazol-3-yl)pyridine);4-(4-ethyl-1,2,4-triazol-3-yl)pyridine (PubChem CID 159282950) has the molecular formula C69H79N27OS and a molecular weight of 1334.65 g/mol. Its IUPAC name is 4-(4-cyclopropyl-5-methylsulfanyl-1,2,4-triazol-3-yl)pyridine;4-(4-cyclopropyl-5-methyl-1,2,4-triazol-3-yl)pyridine;4-(4,5-dimethyl-1,2,4-triazol-3-yl)pyridine;4-ethyl-3-(furan-2-yl)-5-methyl-1,2,4-triazole;bis(4-(4-ethyl-5-methyl-1,2,4-triazol-3-yl)pyridine);4-(4-ethyl-1,2,4-triazol-3-yl)pyridine.

Molecular Properties

• Compound Name: 4-(4-cyclopropyl-5-methylsulfanyl-1,2,4-triazol-3-yl)pyridine;4-(4-cyclopropyl-5-methyl-1,2,4-triazol-3-yl)pyridine;4-(4,5-dimethyl-1,2,4-triazol-3-yl)pyridine;4-ethyl-3-(furan-2-yl)-5-methyl-1,2,4-triazole;bis(4-(4-ethyl-5-methyl-1,2,4-triazol-3-yl)pyridine);4-(4-ethyl-1,2,4-triazol-3-yl)pyridine
• PubChem CID: 159282950
• Molecular Formula: C69H79N27OS
• Molecular Weight: 1334.65 g/mol
• Exact Mass: 1333.67
• IUPAC Name: 4-(4-cyclopropyl-5-methylsulfanyl-1,2,4-triazol-3-yl)pyridine;4-(4-cyclopropyl-5-methyl-1,2,4-triazol-3-yl)pyridine;4-(4,5-dimethyl-1,2,4-triazol-3-yl)pyridine;4-ethyl-3-(furan-2-yl)-5-methyl-1,2,4-triazole;bis(4-(4-ethyl-5-methyl-1,2,4-triazol-3-yl)pyridine);4-(4-ethyl-1,2,4-triazol-3-yl)pyridine
• SMILES: CCn1c(C)nnc1-c1ccco1.CCn1c(C)nnc1-c1ccncc1.CCn1c(C)nnc1-c1ccncc1.CCn1cnnc1-c1ccncc1.CSc1nnc(-c2ccncc2)n1C1CC1.Cc1nnc(-c2ccncc2)n1C.Cc1nnc(-c2ccncc2)n1C1CC1
• InChI: InChI=1S/C11H12N4S.C11H12N4.2C10H12N4.2C9H10N4.C9H11N3O/c1-16-11-14-13-10(15(11)9-2-3-9)8-4-6-12-7-5-8;1-8-13-14-11(15(8)10-2-3-10)9-4-6-12-7-5-9;2*1-3-14-8(2)12-13-10(14)9-4-6-11-7-5-9;1-7-11-12-9(13(7)2)8-3-5-10-6-4-8;1-2-13-7-11-12-9(13)8-3-5-10-6-4-8;1-3-12-7(2)10-11-9(12)8-5-4-6-13-8/h4-7,9H,2-3H2,1H3;4-7,10H,2-3H2,1H3;2*4-7H,3H2,1-2H3;3-6H,1-2H3;3-7H,2H2,1H3;4-6H,3H2,1-2H3
• InChIKey: KZDPOGLQGBAYHU-UHFFFAOYSA-N
• XLogP: 12.13
• TPSA: 305.45 Ų
• H-Bond Acceptors: 29
• Rotatable Bonds: 14
• Heavy Atoms: 98
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1334.65
LogP ≤ 5	12.13
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	29

Frequently Asked Questions

What is the IUPAC name of 4-(4-cyclopropyl-5-methylsulfanyl-1,2,4-triazol-3-yl)pyridine;4-(4-cyclopropyl-5-methyl-1,2,4-triazol-3-yl)pyridine;4-(4,5-dimethyl-1,2,4-triazol-3-yl)pyridine;4-ethyl-3-(furan-2-yl)-5-methyl-1,2,4-triazole;bis(4-(4-ethyl-5-methyl-1,2,4-triazol-3-yl)pyridine);4-(4-ethyl-1,2,4-triazol-3-yl)pyridine?

The IUPAC name of 4-(4-cyclopropyl-5-methylsulfanyl-1,2,4-triazol-3-yl)pyridine;4-(4-cyclopropyl-5-methyl-1,2,4-triazol-3-yl)pyridine;4-(4,5-dimethyl-1,2,4-triazol-3-yl)pyridine;4-ethyl-3-(furan-2-yl)-5-methyl-1,2,4-triazole;bis(4-(4-ethyl-5-methyl-1,2,4-triazol-3-yl)pyridine);4-(4-ethyl-1,2,4-triazol-3-yl)pyridine (CID 159282950) is 4-(4-cyclopropyl-5-methylsulfanyl-1,2,4-triazol-3-yl)pyridine;4-(4-cyclopropyl-5-methyl-1,2,4-triazol-3-yl)pyridine;4-(4,5-dimethyl-1,2,4-triazol-3-yl)pyridine;4-ethyl-3-(furan-2-yl)-5-methyl-1,2,4-triazole;bis(4-(4-ethyl-5-methyl-1,2,4-triazol-3-yl)pyridine);4-(4-ethyl-1,2,4-triazol-3-yl)pyridine.

What is the SMILES notation for 4-(4-cyclopropyl-5-methylsulfanyl-1,2,4-triazol-3-yl)pyridine;4-(4-cyclopropyl-5-methyl-1,2,4-triazol-3-yl)pyridine;4-(4,5-dimethyl-1,2,4-triazol-3-yl)pyridine;4-ethyl-3-(furan-2-yl)-5-methyl-1,2,4-triazole;bis(4-(4-ethyl-5-methyl-1,2,4-triazol-3-yl)pyridine);4-(4-ethyl-1,2,4-triazol-3-yl)pyridine?

The canonical SMILES for 4-(4-cyclopropyl-5-methylsulfanyl-1,2,4-triazol-3-yl)pyridine;4-(4-cyclopropyl-5-methyl-1,2,4-triazol-3-yl)pyridine;4-(4,5-dimethyl-1,2,4-triazol-3-yl)pyridine;4-ethyl-3-(furan-2-yl)-5-methyl-1,2,4-triazole;bis(4-(4-ethyl-5-methyl-1,2,4-triazol-3-yl)pyridine);4-(4-ethyl-1,2,4-triazol-3-yl)pyridine is CCn1c(C)nnc1-c1ccco1.CCn1c(C)nnc1-c1ccncc1.CCn1c(C)nnc1-c1ccncc1.CCn1cnnc1-c1ccncc1.CSc1nnc(-c2ccncc2)n1C1CC1.Cc1nnc(-c2ccncc2)n1C.Cc1nnc(-c2ccncc2)n1C1CC1.

What is the InChIKey of 4-(4-cyclopropyl-5-methylsulfanyl-1,2,4-triazol-3-yl)pyridine;4-(4-cyclopropyl-5-methyl-1,2,4-triazol-3-yl)pyridine;4-(4,5-dimethyl-1,2,4-triazol-3-yl)pyridine;4-ethyl-3-(furan-2-yl)-5-methyl-1,2,4-triazole;bis(4-(4-ethyl-5-methyl-1,2,4-triazol-3-yl)pyridine);4-(4-ethyl-1,2,4-triazol-3-yl)pyridine?

The InChIKey is KZDPOGLQGBAYHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N4S.C11H12N4.2C10H12N4.2C9H10N4.C9H11N3O/c1-16-11-14-13-10(15(11)9-2-3-9)8-4-6-12-7-5-8;1-8-13-14-11(15(8)10-2-3-10)9-4-6-12-7-5-9;2*1-3-14-8(2)12-13-10(14)9-4-6-11-7-5-9;1-7-11-12-9(13(7)2)8-3-5-10-6-4-8;1-2-13-7-11-12-9(13)8-3-5-10-6-4-8;1-3-12-7(2)10-11-9(12)8-5-4-6-13-8/h4-7,9H,2-3H2,1H3;4-7,10H,2-3H2,1H3;2*4-7H,3H2,1-2H3;3-6H,1-2H3;3-7H,2H2,1H3;4-6H,3H2,1-2H3.

What are the key properties of 4-(4-cyclopropyl-5-methylsulfanyl-1,2,4-triazol-3-yl)pyridine;4-(4-cyclopropyl-5-methyl-1,2,4-triazol-3-yl)pyridine;4-(4,5-dimethyl-1,2,4-triazol-3-yl)pyridine;4-ethyl-3-(furan-2-yl)-5-methyl-1,2,4-triazole;bis(4-(4-ethyl-5-methyl-1,2,4-triazol-3-yl)pyridine);4-(4-ethyl-1,2,4-triazol-3-yl)pyridine?

4-(4-cyclopropyl-5-methylsulfanyl-1,2,4-triazol-3-yl)pyridine;4-(4-cyclopropyl-5-methyl-1,2,4-triazol-3-yl)pyridine;4-(4,5-dimethyl-1,2,4-triazol-3-yl)pyridine;4-ethyl-3-(furan-2-yl)-5-methyl-1,2,4-triazole;bis(4-(4-ethyl-5-methyl-1,2,4-triazol-3-yl)pyridine);4-(4-ethyl-1,2,4-triazol-3-yl)pyridine has a molecular weight of 1334.65 g/mol, XLogP of 12.13, 14 rotatable bonds, 0 hydrogen bond donors, and 29 hydrogen bond acceptors.

Where does this data come from?

All data for 4-(4-cyclopropyl-5-methylsulfanyl-1,2,4-triazol-3-yl)pyridine;4-(4-cyclopropyl-5-methyl-1,2,4-triazol-3-yl)pyridine;4-(4,5-dimethyl-1,2,4-triazol-3-yl)pyridine;4-ethyl-3-(furan-2-yl)-5-methyl-1,2,4-triazole;bis(4-(4-ethyl-5-methyl-1,2,4-triazol-3-yl)pyridine);4-(4-ethyl-1,2,4-triazol-3-yl)pyridine is sourced from PubChem (CID 159282950), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).