2,3-dimethyl-4,5-dihydropyrimidin-6-one;1,2-dimethyl-2,3-dihydropyrrolo[2,3-b]pyridine;1,5-dimethyltetrazole;1,3-dimethyl-1,2,4-triazole;ethane;methane;2-methylpyridine;bis(2-methyl-1,3-thiazole);1,2,3,4,5-pentamethylpyrrole;2-phenylguanidine;1,2,4,5-tetramethylimidazole;bis(1,3,5-trimethyl-1,2,4-triazole);3,4,5-trimethyl-1,2,4-triazole

C89H167N29OS2 — CID 159186685

About 2,3-dimethyl-4,5-dihydropyrimidin-6-one;1,2-dimethyl-2,3-dihydropyrrolo[2,3-b]pyridine;1,5-dimethyltetrazole;1,3-dimethyl-1,2,4-triazole;ethane;methane;2-methylpyridine;bis(2-methyl-1,3-thiazole);1,2,3,4,5-pentamethylpyrrole;2-phenylguanidine;1,2,4,5-tetramethylimidazole;bis(1,3,5-trimethyl-1,2,4-triazole);3,4,5-trimethyl-1,2,4-triazole

2,3-dimethyl-4,5-dihydropyrimidin-6-one;1,2-dimethyl-2,3-dihydropyrrolo[2,3-b]pyridine;1,5-dimethyltetrazole;1,3-dimethyl-1,2,4-triazole;ethane;methane;2-methylpyridine;bis(2-methyl-1,3-thiazole);1,2,3,4,5-pentamethylpyrrole;2-phenylguanidine;1,2,4,5-tetramethylimidazole;bis(1,3,5-trimethyl-1,2,4-triazole);3,4,5-trimethyl-1,2,4-triazole (PubChem CID 159186685) has the molecular formula C89H167N29OS2 and a molecular weight of 1723.65 g/mol. Its IUPAC name is 2,3-dimethyl-4,5-dihydropyrimidin-6-one;1,2-dimethyl-2,3-dihydropyrrolo[2,3-b]pyridine;1,5-dimethyltetrazole;1,3-dimethyl-1,2,4-triazole;ethane;methane;2-methylpyridine;bis(2-methyl-1,3-thiazole);1,2,3,4,5-pentamethylpyrrole;2-phenylguanidine;1,2,4,5-tetramethylimidazole;bis(1,3,5-trimethyl-1,2,4-triazole);3,4,5-trimethyl-1,2,4-triazole.

Molecular Properties

• Compound Name: 2,3-dimethyl-4,5-dihydropyrimidin-6-one;1,2-dimethyl-2,3-dihydropyrrolo[2,3-b]pyridine;1,5-dimethyltetrazole;1,3-dimethyl-1,2,4-triazole;ethane;methane;2-methylpyridine;bis(2-methyl-1,3-thiazole);1,2,3,4,5-pentamethylpyrrole;2-phenylguanidine;1,2,4,5-tetramethylimidazole;bis(1,3,5-trimethyl-1,2,4-triazole);3,4,5-trimethyl-1,2,4-triazole
• PubChem CID: 159186685
• Molecular Formula: C89H167N29OS2
• Molecular Weight: 1723.65 g/mol
• Exact Mass: 1722.33
• IUPAC Name: 2,3-dimethyl-4,5-dihydropyrimidin-6-one;1,2-dimethyl-2,3-dihydropyrrolo[2,3-b]pyridine;1,5-dimethyltetrazole;1,3-dimethyl-1,2,4-triazole;ethane;methane;2-methylpyridine;bis(2-methyl-1,3-thiazole);1,2,3,4,5-pentamethylpyrrole;2-phenylguanidine;1,2,4,5-tetramethylimidazole;bis(1,3,5-trimethyl-1,2,4-triazole);3,4,5-trimethyl-1,2,4-triazole
• SMILES: C.C.C.C.C.C.C.CC.CC.CC.CC.CC1=NC(=O)CCN1C.CC1Cc2cccnc2N1C.Cc1c(C)c(C)n(C)c1C.Cc1ccccn1.Cc1nc(C)n(C)c1C.Cc1nc(C)n(C)n1.Cc1nc(C)n(C)n1.Cc1nccs1.Cc1nccs1.Cc1ncn(C)n1.Cc1nnc(C)n1C.Cc1nnnn1C.NC(N)=Nc1ccccc1
• InChI: InChI=1S/C9H12N2.C9H15N.C7H9N3.C7H12N2.C6H10N2O.C6H7N.3C5H9N3.C4H7N3.2C4H5NS.C3H6N4.4C2H6.7CH4/c1-7-6-8-4-3-5-10-9(8)11(7)2;1-6-7(2)9(4)10(5)8(6)3;8-7(9)10-6-4-2-1-3-5-6;1-5-6(2)9(4)7(3)8-5;1-5-7-6(9)3-4-8(5)2;1-6-4-2-3-5-7-6;1-4-6-7-5(2)8(4)3;2*1-4-6-5(2)8(3)7-4;1-4-5-3-7(2)6-4;2*1-4-5-2-3-6-4;1-3-4-5-6-7(3)2;4*1-2;;;;;;;/h3-5,7H,6H2,1-2H3;1-5H3;1-5H,(H4,8,9,10);1-4H3;3-4H2,1-2H3;2-5H,1H3;3*1-3H3;3H,1-2H3;2*2-3H,1H3;1-2H3;4*1-2H3;7*1H4
• InChIKey: KNOSCXWPBBUFFE-UHFFFAOYSA-N
• XLogP: 19.71
• TPSA: 341.06 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 29
• Rotatable Bonds: 1
• Heavy Atoms: 121
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1723.65
LogP ≤ 5	19.71
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	29

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 2,3-dimethyl-4,5-dihydropyrimidin-6-one;1,2-dimethyl-2,3-dihydropyrrolo[2,3-b]pyridine;1,5-dimethyltetrazole;1,3-dimethyl-1,2,4-triazole;ethane;methane;2-methylpyridine;bis(2-methyl-1,3-thiazole);1,2,3,4,5-pentamethylpyrrole;2-phenylguanidine;1,2,4,5-tetramethylimidazole;bis(1,3,5-trimethyl-1,2,4-triazole);3,4,5-trimethyl-1,2,4-triazole?

The IUPAC name of 2,3-dimethyl-4,5-dihydropyrimidin-6-one;1,2-dimethyl-2,3-dihydropyrrolo[2,3-b]pyridine;1,5-dimethyltetrazole;1,3-dimethyl-1,2,4-triazole;ethane;methane;2-methylpyridine;bis(2-methyl-1,3-thiazole);1,2,3,4,5-pentamethylpyrrole;2-phenylguanidine;1,2,4,5-tetramethylimidazole;bis(1,3,5-trimethyl-1,2,4-triazole);3,4,5-trimethyl-1,2,4-triazole (CID 159186685) is 2,3-dimethyl-4,5-dihydropyrimidin-6-one;1,2-dimethyl-2,3-dihydropyrrolo[2,3-b]pyridine;1,5-dimethyltetrazole;1,3-dimethyl-1,2,4-triazole;ethane;methane;2-methylpyridine;bis(2-methyl-1,3-thiazole);1,2,3,4,5-pentamethylpyrrole;2-phenylguanidine;1,2,4,5-tetramethylimidazole;bis(1,3,5-trimethyl-1,2,4-triazole);3,4,5-trimethyl-1,2,4-triazole.

What is the SMILES notation for 2,3-dimethyl-4,5-dihydropyrimidin-6-one;1,2-dimethyl-2,3-dihydropyrrolo[2,3-b]pyridine;1,5-dimethyltetrazole;1,3-dimethyl-1,2,4-triazole;ethane;methane;2-methylpyridine;bis(2-methyl-1,3-thiazole);1,2,3,4,5-pentamethylpyrrole;2-phenylguanidine;1,2,4,5-tetramethylimidazole;bis(1,3,5-trimethyl-1,2,4-triazole);3,4,5-trimethyl-1,2,4-triazole?

The canonical SMILES for 2,3-dimethyl-4,5-dihydropyrimidin-6-one;1,2-dimethyl-2,3-dihydropyrrolo[2,3-b]pyridine;1,5-dimethyltetrazole;1,3-dimethyl-1,2,4-triazole;ethane;methane;2-methylpyridine;bis(2-methyl-1,3-thiazole);1,2,3,4,5-pentamethylpyrrole;2-phenylguanidine;1,2,4,5-tetramethylimidazole;bis(1,3,5-trimethyl-1,2,4-triazole);3,4,5-trimethyl-1,2,4-triazole is C.C.C.C.C.C.C.CC.CC.CC.CC.CC1=NC(=O)CCN1C.CC1Cc2cccnc2N1C.Cc1c(C)c(C)n(C)c1C.Cc1ccccn1.Cc1nc(C)n(C)c1C.Cc1nc(C)n(C)n1.Cc1nc(C)n(C)n1.Cc1nccs1.Cc1nccs1.Cc1ncn(C)n1.Cc1nnc(C)n1C.Cc1nnnn1C.NC(N)=Nc1ccccc1.

What is the InChIKey of 2,3-dimethyl-4,5-dihydropyrimidin-6-one;1,2-dimethyl-2,3-dihydropyrrolo[2,3-b]pyridine;1,5-dimethyltetrazole;1,3-dimethyl-1,2,4-triazole;ethane;methane;2-methylpyridine;bis(2-methyl-1,3-thiazole);1,2,3,4,5-pentamethylpyrrole;2-phenylguanidine;1,2,4,5-tetramethylimidazole;bis(1,3,5-trimethyl-1,2,4-triazole);3,4,5-trimethyl-1,2,4-triazole?

The InChIKey is KNOSCXWPBBUFFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N2.C9H15N.C7H9N3.C7H12N2.C6H10N2O.C6H7N.3C5H9N3.C4H7N3.2C4H5NS.C3H6N4.4C2H6.7CH4/c1-7-6-8-4-3-5-10-9(8)11(7)2;1-6-7(2)9(4)10(5)8(6)3;8-7(9)10-6-4-2-1-3-5-6;1-5-6(2)9(4)7(3)8-5;1-5-7-6(9)3-4-8(5)2;1-6-4-2-3-5-7-6;1-4-6-7-5(2)8(4)3;2*1-4-6-5(2)8(3)7-4;1-4-5-3-7(2)6-4;2*1-4-5-2-3-6-4;1-3-4-5-6-7(3)2;4*1-2;;;;;;;/h3-5,7H,6H2,1-2H3;1-5H3;1-5H,(H4,8,9,10);1-4H3;3-4H2,1-2H3;2-5H,1H3;3*1-3H3;3H,1-2H3;2*2-3H,1H3;1-2H3;4*1-2H3;7*1H4.

What are the key properties of 2,3-dimethyl-4,5-dihydropyrimidin-6-one;1,2-dimethyl-2,3-dihydropyrrolo[2,3-b]pyridine;1,5-dimethyltetrazole;1,3-dimethyl-1,2,4-triazole;ethane;methane;2-methylpyridine;bis(2-methyl-1,3-thiazole);1,2,3,4,5-pentamethylpyrrole;2-phenylguanidine;1,2,4,5-tetramethylimidazole;bis(1,3,5-trimethyl-1,2,4-triazole);3,4,5-trimethyl-1,2,4-triazole?

2,3-dimethyl-4,5-dihydropyrimidin-6-one;1,2-dimethyl-2,3-dihydropyrrolo[2,3-b]pyridine;1,5-dimethyltetrazole;1,3-dimethyl-1,2,4-triazole;ethane;methane;2-methylpyridine;bis(2-methyl-1,3-thiazole);1,2,3,4,5-pentamethylpyrrole;2-phenylguanidine;1,2,4,5-tetramethylimidazole;bis(1,3,5-trimethyl-1,2,4-triazole);3,4,5-trimethyl-1,2,4-triazole has a molecular weight of 1723.65 g/mol, XLogP of 19.71, 1 rotatable bonds, 2 hydrogen bond donors, and 29 hydrogen bond acceptors.

Where does this data come from?

All data for 2,3-dimethyl-4,5-dihydropyrimidin-6-one;1,2-dimethyl-2,3-dihydropyrrolo[2,3-b]pyridine;1,5-dimethyltetrazole;1,3-dimethyl-1,2,4-triazole;ethane;methane;2-methylpyridine;bis(2-methyl-1,3-thiazole);1,2,3,4,5-pentamethylpyrrole;2-phenylguanidine;1,2,4,5-tetramethylimidazole;bis(1,3,5-trimethyl-1,2,4-triazole);3,4,5-trimethyl-1,2,4-triazole is sourced from PubChem (CID 159186685), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).