Bis(3,5-dimethyl-1,2-oxazole);4,5-dimethyl-1,2-oxazole;(5R)-1,5-dimethylpiperidin-2-one;bis(1,4-dimethylpyrazole);4,5-dimethyl-1H-pyrazole;2,3-dimethylpyridine;bis(2,4-dimethylpyridine);bis(2,5-dimethylpyridine);3,4-dimethylpyridine;3,5-dimethylpyridine;1,4-dimethylpyridin-2-one;bis(1,5-dimethylpyridin-2-one);bis(2,5-dimethylpyrimidine);(2S)-1,2-dimethylpyrrolidine;4,5-dimethyl-1,2-thiazole;bis(1,2-xylene);1,3-xylene

C₁₅₄H₂₁₄N₂₆O₇S — CID 158526694

About Bis(3,5-dimethyl-1,2-oxazole);4,5-dimethyl-1,2-oxazole;(5R)-1,5-dimethylpiperidin-2-one;bis(1,4-dimethylpyrazole);4,5-dimethyl-1H-pyrazole;2,3-dimethylpyridine;bis(2,4-dimethylpyridine);bis(2,5-dimethylpyridine);3,4-dimethylpyridine;3,5-dimethylpyridine;1,4-dimethylpyridin-2-one;bis(1,5-dimethylpyridin-2-one);bis(2,5-dimethylpyrimidine);(2S)-1,2-dimethylpyrrolidine;4,5-dimethyl-1,2-thiazole;bis(1,2-xylene);1,3-xylene

Bis(3,5-dimethyl-1,2-oxazole);4,5-dimethyl-1,2-oxazole;(5R)-1,5-dimethylpiperidin-2-one;bis(1,4-dimethylpyrazole);4,5-dimethyl-1H-pyrazole;2,3-dimethylpyridine;bis(2,4-dimethylpyridine);bis(2,5-dimethylpyridine);3,4-dimethylpyridine;3,5-dimethylpyridine;1,4-dimethylpyridin-2-one;bis(1,5-dimethylpyridin-2-one);bis(2,5-dimethylpyrimidine);(2S)-1,2-dimethylpyrrolidine;4,5-dimethyl-1,2-thiazole;bis(1,2-xylene);1,3-xylene (PubChem CID 158526694) has the molecular formula C₁₅₄H₂₁₄N₂₆O₇S and a molecular weight of 2573.65 g/mol. Its IUPAC name is bis(3,5-dimethyl-1,2-oxazole);4,5-dimethyl-1,2-oxazole;(5R)-1,5-dimethylpiperidin-2-one;bis(1,4-dimethylpyrazole);4,5-dimethyl-1H-pyrazole;2,3-dimethylpyridine;bis(2,4-dimethylpyridine);bis(2,5-dimethylpyridine);3,4-dimethylpyridine;3,5-dimethylpyridine;1,4-dimethylpyridin-2-one;bis(1,5-dimethylpyridin-2-one);bis(2,5-dimethylpyrimidine);(2S)-1,2-dimethylpyrrolidine;4,5-dimethyl-1,2-thiazole;bis(1,2-xylene);1,3-xylene.

Molecular Properties

• Compound Name: Bis(3,5-dimethyl-1,2-oxazole);4,5-dimethyl-1,2-oxazole;(5R)-1,5-dimethylpiperidin-2-one;bis(1,4-dimethylpyrazole);4,5-dimethyl-1H-pyrazole;2,3-dimethylpyridine;bis(2,4-dimethylpyridine);bis(2,5-dimethylpyridine);3,4-dimethylpyridine;3,5-dimethylpyridine;1,4-dimethylpyridin-2-one;bis(1,5-dimethylpyridin-2-one);bis(2,5-dimethylpyrimidine);(2S)-1,2-dimethylpyrrolidine;4,5-dimethyl-1,2-thiazole;bis(1,2-xylene);1,3-xylene
• PubChem CID: 158526694
• Molecular Formula: C₁₅₄H₂₁₄N₂₆O₇S
• Molecular Weight: 2573.65 g/mol
• Exact Mass: 2571.69
• IUPAC Name: bis(3,5-dimethyl-1,2-oxazole);4,5-dimethyl-1,2-oxazole;(5R)-1,5-dimethylpiperidin-2-one;bis(1,4-dimethylpyrazole);4,5-dimethyl-1H-pyrazole;2,3-dimethylpyridine;bis(2,4-dimethylpyridine);bis(2,5-dimethylpyridine);3,4-dimethylpyridine;3,5-dimethylpyridine;1,4-dimethylpyridin-2-one;bis(1,5-dimethylpyridin-2-one);bis(2,5-dimethylpyrimidine);(2S)-1,2-dimethylpyrrolidine;4,5-dimethyl-1,2-thiazole;bis(1,2-xylene);1,3-xylene
• SMILES: C[C@@H]1CCC(=O)N(C)C1.C[C@H]1CCCN1C.Cc1cc(C)on1.Cc1cc(C)on1.Cc1ccc(=O)n(C)c1.Cc1ccc(=O)n(C)c1.Cc1ccc(C)nc1.Cc1ccc(C)nc1.Cc1cccc(C)c1.Cc1ccccc1C.Cc1ccccc1C.Cc1cccnc1C.Cc1ccn(C)c(=O)c1.Cc1ccnc(C)c1.Cc1ccnc(C)c1.Cc1ccncc1C.Cc1cn[nH]c1C.Cc1cnc(C)nc1.Cc1cnc(C)nc1.Cc1cncc(C)c1.Cc1cnn(C)c1.Cc1cnn(C)c1.Cc1cnoc1C.Cc1cnsc1C
• InChI: InChI=1S/3C8H10.C7H9NO.C7H13NO.2C7H9NO.7C7H9N.2C6H8N2.C6H13N.3C5H8N2.3C5H7NO.C5H7NS/c1-7-4-3-5-8(2)6-7;2*1-7-5-3-4-6-8(7)2;1-6-3-4-8(2)7(9)5-6;3*1-6-3-4-7(9)8(2)5-6;1-6-3-7(2)5-8-4-6;1-6-3-4-8-5-7(6)2;2*1-6-3-4-8-7(2)5-6;2*1-6-3-4-7(2)8-5-6;1-6-4-3-5-8-7(6)2;2*1-5-3-7-6(2)8-4-5;1-6-4-3-5-7(6)2;2*1-5-3-6-7(2)4-5;2*1-4-3-6-7-5(4)2;2*1-4-3-5(2)7-6-4;1-4-3-6-7-5(4)2/h3*3-6H,1-2H3;3-5H,1-2H3;6H,3-5H2,1-2H3;2*3-5H,1-2H3;7*3-5H,1-2H3;2*3-4H,1-2H3;6H,3-5H2,1-2H3;2*3-4H,1-2H3;3H,1-2H3,(H,6,7);4*3H,1-2H3/t;;;;6-;;;;;;;;;;;;6-;;;;;;;/m....1...........0......./s1
• InChIKey: HMWGLVMYYARCSN-VMHMRHQQSA-N
• XLogP: 33.16
• TPSA: 386.64 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 32
• Heavy Atoms: 188
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2573.65
LogP ≤ 5	33.16
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	32

Frequently Asked Questions

What is the IUPAC name of Bis(3,5-dimethyl-1,2-oxazole);4,5-dimethyl-1,2-oxazole;(5R)-1,5-dimethylpiperidin-2-one;bis(1,4-dimethylpyrazole);4,5-dimethyl-1H-pyrazole;2,3-dimethylpyridine;bis(2,4-dimethylpyridine);bis(2,5-dimethylpyridine);3,4-dimethylpyridine;3,5-dimethylpyridine;1,4-dimethylpyridin-2-one;bis(1,5-dimethylpyridin-2-one);bis(2,5-dimethylpyrimidine);(2S)-1,2-dimethylpyrrolidine;4,5-dimethyl-1,2-thiazole;bis(1,2-xylene);1,3-xylene?

The IUPAC name of Bis(3,5-dimethyl-1,2-oxazole);4,5-dimethyl-1,2-oxazole;(5R)-1,5-dimethylpiperidin-2-one;bis(1,4-dimethylpyrazole);4,5-dimethyl-1H-pyrazole;2,3-dimethylpyridine;bis(2,4-dimethylpyridine);bis(2,5-dimethylpyridine);3,4-dimethylpyridine;3,5-dimethylpyridine;1,4-dimethylpyridin-2-one;bis(1,5-dimethylpyridin-2-one);bis(2,5-dimethylpyrimidine);(2S)-1,2-dimethylpyrrolidine;4,5-dimethyl-1,2-thiazole;bis(1,2-xylene);1,3-xylene (CID 158526694) is bis(3,5-dimethyl-1,2-oxazole);4,5-dimethyl-1,2-oxazole;(5R)-1,5-dimethylpiperidin-2-one;bis(1,4-dimethylpyrazole);4,5-dimethyl-1H-pyrazole;2,3-dimethylpyridine;bis(2,4-dimethylpyridine);bis(2,5-dimethylpyridine);3,4-dimethylpyridine;3,5-dimethylpyridine;1,4-dimethylpyridin-2-one;bis(1,5-dimethylpyridin-2-one);bis(2,5-dimethylpyrimidine);(2S)-1,2-dimethylpyrrolidine;4,5-dimethyl-1,2-thiazole;bis(1,2-xylene);1,3-xylene.

What is the SMILES notation for Bis(3,5-dimethyl-1,2-oxazole);4,5-dimethyl-1,2-oxazole;(5R)-1,5-dimethylpiperidin-2-one;bis(1,4-dimethylpyrazole);4,5-dimethyl-1H-pyrazole;2,3-dimethylpyridine;bis(2,4-dimethylpyridine);bis(2,5-dimethylpyridine);3,4-dimethylpyridine;3,5-dimethylpyridine;1,4-dimethylpyridin-2-one;bis(1,5-dimethylpyridin-2-one);bis(2,5-dimethylpyrimidine);(2S)-1,2-dimethylpyrrolidine;4,5-dimethyl-1,2-thiazole;bis(1,2-xylene);1,3-xylene?

The canonical SMILES for Bis(3,5-dimethyl-1,2-oxazole);4,5-dimethyl-1,2-oxazole;(5R)-1,5-dimethylpiperidin-2-one;bis(1,4-dimethylpyrazole);4,5-dimethyl-1H-pyrazole;2,3-dimethylpyridine;bis(2,4-dimethylpyridine);bis(2,5-dimethylpyridine);3,4-dimethylpyridine;3,5-dimethylpyridine;1,4-dimethylpyridin-2-one;bis(1,5-dimethylpyridin-2-one);bis(2,5-dimethylpyrimidine);(2S)-1,2-dimethylpyrrolidine;4,5-dimethyl-1,2-thiazole;bis(1,2-xylene);1,3-xylene is C[C@@H]1CCC(=O)N(C)C1.C[C@H]1CCCN1C.Cc1cc(C)on1.Cc1cc(C)on1.Cc1ccc(=O)n(C)c1.Cc1ccc(=O)n(C)c1.Cc1ccc(C)nc1.Cc1ccc(C)nc1.Cc1cccc(C)c1.Cc1ccccc1C.Cc1ccccc1C.Cc1cccnc1C.Cc1ccn(C)c(=O)c1.Cc1ccnc(C)c1.Cc1ccnc(C)c1.Cc1ccncc1C.Cc1cn[nH]c1C.Cc1cnc(C)nc1.Cc1cnc(C)nc1.Cc1cncc(C)c1.Cc1cnn(C)c1.Cc1cnn(C)c1.Cc1cnoc1C.Cc1cnsc1C.

What is the InChIKey of Bis(3,5-dimethyl-1,2-oxazole);4,5-dimethyl-1,2-oxazole;(5R)-1,5-dimethylpiperidin-2-one;bis(1,4-dimethylpyrazole);4,5-dimethyl-1H-pyrazole;2,3-dimethylpyridine;bis(2,4-dimethylpyridine);bis(2,5-dimethylpyridine);3,4-dimethylpyridine;3,5-dimethylpyridine;1,4-dimethylpyridin-2-one;bis(1,5-dimethylpyridin-2-one);bis(2,5-dimethylpyrimidine);(2S)-1,2-dimethylpyrrolidine;4,5-dimethyl-1,2-thiazole;bis(1,2-xylene);1,3-xylene?

The InChIKey is HMWGLVMYYARCSN-VMHMRHQQSA-N. The full InChI is InChI=1S/3C8H10.C7H9NO.C7H13NO.2C7H9NO.7C7H9N.2C6H8N2.C6H13N.3C5H8N2.3C5H7NO.C5H7NS/c1-7-4-3-5-8(2)6-7;2*1-7-5-3-4-6-8(7)2;1-6-3-4-8(2)7(9)5-6;3*1-6-3-4-7(9)8(2)5-6;1-6-3-7(2)5-8-4-6;1-6-3-4-8-5-7(6)2;2*1-6-3-4-8-7(2)5-6;2*1-6-3-4-7(2)8-5-6;1-6-4-3-5-8-7(6)2;2*1-5-3-7-6(2)8-4-5;1-6-4-3-5-7(6)2;2*1-5-3-6-7(2)4-5;2*1-4-3-6-7-5(4)2;2*1-4-3-5(2)7-6-4;1-4-3-6-7-5(4)2/h3*3-6H,1-2H3;3-5H,1-2H3;6H,3-5H2,1-2H3;2*3-5H,1-2H3;7*3-5H,1-2H3;2*3-4H,1-2H3;6H,3-5H2,1-2H3;2*3-4H,1-2H3;3H,1-2H3,(H,6,7);4*3H,1-2H3/t;;;;6-;;;;;;;;;;;;6-;;;;;;;/m....1...........0......./s1.

What are the key properties of Bis(3,5-dimethyl-1,2-oxazole);4,5-dimethyl-1,2-oxazole;(5R)-1,5-dimethylpiperidin-2-one;bis(1,4-dimethylpyrazole);4,5-dimethyl-1H-pyrazole;2,3-dimethylpyridine;bis(2,4-dimethylpyridine);bis(2,5-dimethylpyridine);3,4-dimethylpyridine;3,5-dimethylpyridine;1,4-dimethylpyridin-2-one;bis(1,5-dimethylpyridin-2-one);bis(2,5-dimethylpyrimidine);(2S)-1,2-dimethylpyrrolidine;4,5-dimethyl-1,2-thiazole;bis(1,2-xylene);1,3-xylene?

Bis(3,5-dimethyl-1,2-oxazole);4,5-dimethyl-1,2-oxazole;(5R)-1,5-dimethylpiperidin-2-one;bis(1,4-dimethylpyrazole);4,5-dimethyl-1H-pyrazole;2,3-dimethylpyridine;bis(2,4-dimethylpyridine);bis(2,5-dimethylpyridine);3,4-dimethylpyridine;3,5-dimethylpyridine;1,4-dimethylpyridin-2-one;bis(1,5-dimethylpyridin-2-one);bis(2,5-dimethylpyrimidine);(2S)-1,2-dimethylpyrrolidine;4,5-dimethyl-1,2-thiazole;bis(1,2-xylene);1,3-xylene has a molecular weight of 2573.65 g/mol, XLogP of 33.16, 0 rotatable bonds, 1 hydrogen bond donors, and 32 hydrogen bond acceptors.

Where does this data come from?

All data for Bis(3,5-dimethyl-1,2-oxazole);4,5-dimethyl-1,2-oxazole;(5R)-1,5-dimethylpiperidin-2-one;bis(1,4-dimethylpyrazole);4,5-dimethyl-1H-pyrazole;2,3-dimethylpyridine;bis(2,4-dimethylpyridine);bis(2,5-dimethylpyridine);3,4-dimethylpyridine;3,5-dimethylpyridine;1,4-dimethylpyridin-2-one;bis(1,5-dimethylpyridin-2-one);bis(2,5-dimethylpyrimidine);(2S)-1,2-dimethylpyrrolidine;4,5-dimethyl-1,2-thiazole;bis(1,2-xylene);1,3-xylene is sourced from PubChem (CID 158526694), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 158526694 — identifiers, structure, computed properties (public domain)

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