bis(2,6-dimethyl-7,8-dihydro-5H-1,6-naphthyridine);bis(2,3-dimethylpyridine);bis(2,5-dimethylpyridine);tris(2,6-dimethylpyridine);tetrakis(2,4-dimethyl-1,3-thiazole);bis(1-methylisoquinoline);bis(3-methylisoquinoline);tris(2-methylquinoline)

C159H182N22S4 — CID 159072290

About bis(2,6-dimethyl-7,8-dihydro-5H-1,6-naphthyridine);bis(2,3-dimethylpyridine);bis(2,5-dimethylpyridine);tris(2,6-dimethylpyridine);tetrakis(2,4-dimethyl-1,3-thiazole);bis(1-methylisoquinoline);bis(3-methylisoquinoline);tris(2-methylquinoline)

bis(2,6-dimethyl-7,8-dihydro-5H-1,6-naphthyridine);bis(2,3-dimethylpyridine);bis(2,5-dimethylpyridine);tris(2,6-dimethylpyridine);tetrakis(2,4-dimethyl-1,3-thiazole);bis(1-methylisoquinoline);bis(3-methylisoquinoline);tris(2-methylquinoline) (PubChem CID 159072290) has the molecular formula C159H182N22S4 and a molecular weight of 2529.63 g/mol. Its IUPAC name is bis(2,6-dimethyl-7,8-dihydro-5H-1,6-naphthyridine);bis(2,3-dimethylpyridine);bis(2,5-dimethylpyridine);tris(2,6-dimethylpyridine);tetrakis(2,4-dimethyl-1,3-thiazole);bis(1-methylisoquinoline);bis(3-methylisoquinoline);tris(2-methylquinoline).

Molecular Properties

• Compound Name: bis(2,6-dimethyl-7,8-dihydro-5H-1,6-naphthyridine);bis(2,3-dimethylpyridine);bis(2,5-dimethylpyridine);tris(2,6-dimethylpyridine);tetrakis(2,4-dimethyl-1,3-thiazole);bis(1-methylisoquinoline);bis(3-methylisoquinoline);tris(2-methylquinoline)
• PubChem CID: 159072290
• Molecular Formula: C159H182N22S4
• Molecular Weight: 2529.63 g/mol
• Exact Mass: 2527.38
• IUPAC Name: bis(2,6-dimethyl-7,8-dihydro-5H-1,6-naphthyridine);bis(2,3-dimethylpyridine);bis(2,5-dimethylpyridine);tris(2,6-dimethylpyridine);tetrakis(2,4-dimethyl-1,3-thiazole);bis(1-methylisoquinoline);bis(3-methylisoquinoline);tris(2-methylquinoline)
• SMILES: Cc1cc2ccccc2cn1.Cc1cc2ccccc2cn1.Cc1ccc(C)nc1.Cc1ccc(C)nc1.Cc1ccc2c(n1)CCN(C)C2.Cc1ccc2c(n1)CCN(C)C2.Cc1ccc2ccccc2n1.Cc1ccc2ccccc2n1.Cc1ccc2ccccc2n1.Cc1cccc(C)n1.Cc1cccc(C)n1.Cc1cccc(C)n1.Cc1cccnc1C.Cc1cccnc1C.Cc1csc(C)n1.Cc1csc(C)n1.Cc1csc(C)n1.Cc1csc(C)n1.Cc1nccc2ccccc12.Cc1nccc2ccccc12
• InChI: InChI=1S/2C10H14N2.7C10H9N.7C7H9N.4C5H7NS/c2*1-8-3-4-9-7-12(2)6-5-10(9)11-8;2*1-8-6-9-4-2-3-5-10(9)7-11-8;2*1-8-10-5-3-2-4-9(10)6-7-11-8;3*1-8-6-7-9-4-2-3-5-10(9)11-8;2*1-6-3-4-7(2)8-5-6;2*1-6-4-3-5-8-7(6)2;3*1-6-4-3-5-7(2)8-6;4*1-4-3-7-5(2)6-4/h2*3-4H,5-7H2,1-2H3;7*2-7H,1H3;7*3-5H,1-2H3;4*3H,1-2H3
• InChIKey: JZUUKXFSSKTOAM-UHFFFAOYSA-N
• XLogP: 39.49
• TPSA: 264.28 Ų
• H-Bond Acceptors: 26
• Heavy Atoms: 185
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2529.63
LogP ≤ 5	39.49
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	26

Frequently Asked Questions

What is the IUPAC name of bis(2,6-dimethyl-7,8-dihydro-5H-1,6-naphthyridine);bis(2,3-dimethylpyridine);bis(2,5-dimethylpyridine);tris(2,6-dimethylpyridine);tetrakis(2,4-dimethyl-1,3-thiazole);bis(1-methylisoquinoline);bis(3-methylisoquinoline);tris(2-methylquinoline)?

The IUPAC name of bis(2,6-dimethyl-7,8-dihydro-5H-1,6-naphthyridine);bis(2,3-dimethylpyridine);bis(2,5-dimethylpyridine);tris(2,6-dimethylpyridine);tetrakis(2,4-dimethyl-1,3-thiazole);bis(1-methylisoquinoline);bis(3-methylisoquinoline);tris(2-methylquinoline) (CID 159072290) is bis(2,6-dimethyl-7,8-dihydro-5H-1,6-naphthyridine);bis(2,3-dimethylpyridine);bis(2,5-dimethylpyridine);tris(2,6-dimethylpyridine);tetrakis(2,4-dimethyl-1,3-thiazole);bis(1-methylisoquinoline);bis(3-methylisoquinoline);tris(2-methylquinoline).

What is the SMILES notation for bis(2,6-dimethyl-7,8-dihydro-5H-1,6-naphthyridine);bis(2,3-dimethylpyridine);bis(2,5-dimethylpyridine);tris(2,6-dimethylpyridine);tetrakis(2,4-dimethyl-1,3-thiazole);bis(1-methylisoquinoline);bis(3-methylisoquinoline);tris(2-methylquinoline)?

The canonical SMILES for bis(2,6-dimethyl-7,8-dihydro-5H-1,6-naphthyridine);bis(2,3-dimethylpyridine);bis(2,5-dimethylpyridine);tris(2,6-dimethylpyridine);tetrakis(2,4-dimethyl-1,3-thiazole);bis(1-methylisoquinoline);bis(3-methylisoquinoline);tris(2-methylquinoline) is Cc1cc2ccccc2cn1.Cc1cc2ccccc2cn1.Cc1ccc(C)nc1.Cc1ccc(C)nc1.Cc1ccc2c(n1)CCN(C)C2.Cc1ccc2c(n1)CCN(C)C2.Cc1ccc2ccccc2n1.Cc1ccc2ccccc2n1.Cc1ccc2ccccc2n1.Cc1cccc(C)n1.Cc1cccc(C)n1.Cc1cccc(C)n1.Cc1cccnc1C.Cc1cccnc1C.Cc1csc(C)n1.Cc1csc(C)n1.Cc1csc(C)n1.Cc1csc(C)n1.Cc1nccc2ccccc12.Cc1nccc2ccccc12.

What is the InChIKey of bis(2,6-dimethyl-7,8-dihydro-5H-1,6-naphthyridine);bis(2,3-dimethylpyridine);bis(2,5-dimethylpyridine);tris(2,6-dimethylpyridine);tetrakis(2,4-dimethyl-1,3-thiazole);bis(1-methylisoquinoline);bis(3-methylisoquinoline);tris(2-methylquinoline)?

The InChIKey is JZUUKXFSSKTOAM-UHFFFAOYSA-N. The full InChI is InChI=1S/2C10H14N2.7C10H9N.7C7H9N.4C5H7NS/c2*1-8-3-4-9-7-12(2)6-5-10(9)11-8;2*1-8-6-9-4-2-3-5-10(9)7-11-8;2*1-8-10-5-3-2-4-9(10)6-7-11-8;3*1-8-6-7-9-4-2-3-5-10(9)11-8;2*1-6-3-4-7(2)8-5-6;2*1-6-4-3-5-8-7(6)2;3*1-6-4-3-5-7(2)8-6;4*1-4-3-7-5(2)6-4/h2*3-4H,5-7H2,1-2H3;7*2-7H,1H3;7*3-5H,1-2H3;4*3H,1-2H3.

What are the key properties of bis(2,6-dimethyl-7,8-dihydro-5H-1,6-naphthyridine);bis(2,3-dimethylpyridine);bis(2,5-dimethylpyridine);tris(2,6-dimethylpyridine);tetrakis(2,4-dimethyl-1,3-thiazole);bis(1-methylisoquinoline);bis(3-methylisoquinoline);tris(2-methylquinoline)?

bis(2,6-dimethyl-7,8-dihydro-5H-1,6-naphthyridine);bis(2,3-dimethylpyridine);bis(2,5-dimethylpyridine);tris(2,6-dimethylpyridine);tetrakis(2,4-dimethyl-1,3-thiazole);bis(1-methylisoquinoline);bis(3-methylisoquinoline);tris(2-methylquinoline) has a molecular weight of 2529.63 g/mol, XLogP of 39.49, 0 rotatable bonds, 0 hydrogen bond donors, and 26 hydrogen bond acceptors.

Where does this data come from?

All data for bis(2,6-dimethyl-7,8-dihydro-5H-1,6-naphthyridine);bis(2,3-dimethylpyridine);bis(2,5-dimethylpyridine);tris(2,6-dimethylpyridine);tetrakis(2,4-dimethyl-1,3-thiazole);bis(1-methylisoquinoline);bis(3-methylisoquinoline);tris(2-methylquinoline) is sourced from PubChem (CID 159072290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).