3,4-dimethyl-5-propan-2-yl-1,2-oxazole;1,4-dimethyl-5-propan-2-ylpyrazole;1,5-dimethyl-4-propan-2-ylpyrazole;3,5-dimethyl-4-propan-2-yl-1H-pyrazole;4,5-dimethyl-3-propan-2-yl-2H-pyrrole;3-methyl-5-propan-2-yl-1,2-oxazole;4-methyl-5-propan-2-yl-1,2-oxazole;5-methyl-4-propan-2-yl-1,2-oxazole;1-methyl-4-propan-2-ylpyrazole;1-methyl-5-propan-2-ylpyrazole;5-methyl-4-propan-2-yl-1H-pyrazole;4-methyl-3-propan-2-yl-2H-pyrrole;5-methyl-3-propan-2-yl-2H-pyrrole;4-propan-2-yl-1,2-oxazole;5-propan-2-yl-1,2-oxazole;4-propan-2-yl-1H-pyrazole;3-propan-2-yl-2H-pyrrole;1,3,5-trimethyl-4-propan-2-ylpyrazole

C133H220N26O6 — CID 164989833

About 3,4-dimethyl-5-propan-2-yl-1,2-oxazole;1,4-dimethyl-5-propan-2-ylpyrazole;1,5-dimethyl-4-propan-2-ylpyrazole;3,5-dimethyl-4-propan-2-yl-1H-pyrazole;4,5-dimethyl-3-propan-2-yl-2H-pyrrole;3-methyl-5-propan-2-yl-1,2-oxazole;4-methyl-5-propan-2-yl-1,2-oxazole;5-methyl-4-propan-2-yl-1,2-oxazole;1-methyl-4-propan-2-ylpyrazole;1-methyl-5-propan-2-ylpyrazole;5-methyl-4-propan-2-yl-1H-pyrazole;4-methyl-3-propan-2-yl-2H-pyrrole;5-methyl-3-propan-2-yl-2H-pyrrole;4-propan-2-yl-1,2-oxazole;5-propan-2-yl-1,2-oxazole;4-propan-2-yl-1H-pyrazole;3-propan-2-yl-2H-pyrrole;1,3,5-trimethyl-4-propan-2-ylpyrazole

3,4-dimethyl-5-propan-2-yl-1,2-oxazole;1,4-dimethyl-5-propan-2-ylpyrazole;1,5-dimethyl-4-propan-2-ylpyrazole;3,5-dimethyl-4-propan-2-yl-1H-pyrazole;4,5-dimethyl-3-propan-2-yl-2H-pyrrole;3-methyl-5-propan-2-yl-1,2-oxazole;4-methyl-5-propan-2-yl-1,2-oxazole;5-methyl-4-propan-2-yl-1,2-oxazole;1-methyl-4-propan-2-ylpyrazole;1-methyl-5-propan-2-ylpyrazole;5-methyl-4-propan-2-yl-1H-pyrazole;4-methyl-3-propan-2-yl-2H-pyrrole;5-methyl-3-propan-2-yl-2H-pyrrole;4-propan-2-yl-1,2-oxazole;5-propan-2-yl-1,2-oxazole;4-propan-2-yl-1H-pyrazole;3-propan-2-yl-2H-pyrrole;1,3,5-trimethyl-4-propan-2-ylpyrazole (PubChem CID 164989833) has the molecular formula C133H220N26O6 and a molecular weight of 2279.40 g/mol. Its IUPAC name is 3,4-dimethyl-5-propan-2-yl-1,2-oxazole;1,4-dimethyl-5-propan-2-ylpyrazole;1,5-dimethyl-4-propan-2-ylpyrazole;3,5-dimethyl-4-propan-2-yl-1H-pyrazole;4,5-dimethyl-3-propan-2-yl-2H-pyrrole;3-methyl-5-propan-2-yl-1,2-oxazole;4-methyl-5-propan-2-yl-1,2-oxazole;5-methyl-4-propan-2-yl-1,2-oxazole;1-methyl-4-propan-2-ylpyrazole;1-methyl-5-propan-2-ylpyrazole;5-methyl-4-propan-2-yl-1H-pyrazole;4-methyl-3-propan-2-yl-2H-pyrrole;5-methyl-3-propan-2-yl-2H-pyrrole;4-propan-2-yl-1,2-oxazole;5-propan-2-yl-1,2-oxazole;4-propan-2-yl-1H-pyrazole;3-propan-2-yl-2H-pyrrole;1,3,5-trimethyl-4-propan-2-ylpyrazole.

Molecular Properties

• Compound Name: 3,4-dimethyl-5-propan-2-yl-1,2-oxazole;1,4-dimethyl-5-propan-2-ylpyrazole;1,5-dimethyl-4-propan-2-ylpyrazole;3,5-dimethyl-4-propan-2-yl-1H-pyrazole;4,5-dimethyl-3-propan-2-yl-2H-pyrrole;3-methyl-5-propan-2-yl-1,2-oxazole;4-methyl-5-propan-2-yl-1,2-oxazole;5-methyl-4-propan-2-yl-1,2-oxazole;1-methyl-4-propan-2-ylpyrazole;1-methyl-5-propan-2-ylpyrazole;5-methyl-4-propan-2-yl-1H-pyrazole;4-methyl-3-propan-2-yl-2H-pyrrole;5-methyl-3-propan-2-yl-2H-pyrrole;4-propan-2-yl-1,2-oxazole;5-propan-2-yl-1,2-oxazole;4-propan-2-yl-1H-pyrazole;3-propan-2-yl-2H-pyrrole;1,3,5-trimethyl-4-propan-2-ylpyrazole
• PubChem CID: 164989833
• Molecular Formula: C133H220N26O6
• Molecular Weight: 2279.40 g/mol
• Exact Mass: 2277.77
• IUPAC Name: 3,4-dimethyl-5-propan-2-yl-1,2-oxazole;1,4-dimethyl-5-propan-2-ylpyrazole;1,5-dimethyl-4-propan-2-ylpyrazole;3,5-dimethyl-4-propan-2-yl-1H-pyrazole;4,5-dimethyl-3-propan-2-yl-2H-pyrrole;3-methyl-5-propan-2-yl-1,2-oxazole;4-methyl-5-propan-2-yl-1,2-oxazole;5-methyl-4-propan-2-yl-1,2-oxazole;1-methyl-4-propan-2-ylpyrazole;1-methyl-5-propan-2-ylpyrazole;5-methyl-4-propan-2-yl-1H-pyrazole;4-methyl-3-propan-2-yl-2H-pyrrole;5-methyl-3-propan-2-yl-2H-pyrrole;4-propan-2-yl-1,2-oxazole;5-propan-2-yl-1,2-oxazole;4-propan-2-yl-1H-pyrazole;3-propan-2-yl-2H-pyrrole;1,3,5-trimethyl-4-propan-2-ylpyrazole
• SMILES: CC(C)C1=CC=NC1.CC(C)c1ccnn1C.CC(C)c1ccno1.CC(C)c1cn[nH]c1.CC(C)c1cnn(C)c1.CC(C)c1cnoc1.CC1=C(C(C)C)CN=C1.CC1=NCC(C(C)C)=C1.CC1=NCC(C(C)C)=C1C.Cc1[nH]ncc1C(C)C.Cc1c(C(C)C)cnn1C.Cc1cc(C(C)C)on1.Cc1cnn(C)c1C(C)C.Cc1cnoc1C(C)C.Cc1n[nH]c(C)c1C(C)C.Cc1nn(C)c(C)c1C(C)C.Cc1noc(C(C)C)c1C.Cc1oncc1C(C)C
• InChI: InChI=1S/C9H16N2.C9H15N.3C8H14N2.C8H13NO.2C8H13N.3C7H12N2.3C7H11NO.C7H11N.C6H10N2.2C6H9NO/c1-6(2)9-7(3)10-11(5)8(9)4;1-6(2)9-5-10-8(4)7(9)3;1-6(2)8-5-9-10(4)7(8)3;1-6(2)8-7(3)5-9-10(8)4;1-5(2)8-6(3)9-10-7(8)4;1-5(2)8-6(3)7(4)9-10-8;1-6(2)8-5-9-4-7(8)3;1-6(2)8-4-7(3)9-5-8;1-6(2)7-4-8-9(3)5-7;1-6(2)7-4-5-8-9(7)3;2*1-5(2)7-4-8-9-6(7)3;1-5(2)7-6(3)4-8-9-7;1-5(2)7-4-6(3)8-9-7;1-6(2)7-3-4-8-5-7;2*1-5(2)6-3-7-8-4-6;1-5(2)6-3-4-7-8-6/h6H,1-5H3;6H,5H2,1-4H3;2*5-6H,1-4H3;5H,1-4H3,(H,9,10);5H,1-4H3;2*4,6H,5H2,1-3H3;2*4-6H,1-3H3;4-5H,1-3H3,(H,8,9);3*4-5H,1-3H3;3-4,6H,5H2,1-2H3;3-5H,1-2H3,(H,7,8);2*3-5H,1-2H3
• InChIKey: GRQWTUQDGGOAMM-UHFFFAOYSA-N
• XLogP: 34.98
• TPSA: 380.76 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 29
• Rotatable Bonds: 18
• Heavy Atoms: 165
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2279.40
LogP ≤ 5	34.98
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	29

Frequently Asked Questions

What is the IUPAC name of 3,4-dimethyl-5-propan-2-yl-1,2-oxazole;1,4-dimethyl-5-propan-2-ylpyrazole;1,5-dimethyl-4-propan-2-ylpyrazole;3,5-dimethyl-4-propan-2-yl-1H-pyrazole;4,5-dimethyl-3-propan-2-yl-2H-pyrrole;3-methyl-5-propan-2-yl-1,2-oxazole;4-methyl-5-propan-2-yl-1,2-oxazole;5-methyl-4-propan-2-yl-1,2-oxazole;1-methyl-4-propan-2-ylpyrazole;1-methyl-5-propan-2-ylpyrazole;5-methyl-4-propan-2-yl-1H-pyrazole;4-methyl-3-propan-2-yl-2H-pyrrole;5-methyl-3-propan-2-yl-2H-pyrrole;4-propan-2-yl-1,2-oxazole;5-propan-2-yl-1,2-oxazole;4-propan-2-yl-1H-pyrazole;3-propan-2-yl-2H-pyrrole;1,3,5-trimethyl-4-propan-2-ylpyrazole?

The IUPAC name of 3,4-dimethyl-5-propan-2-yl-1,2-oxazole;1,4-dimethyl-5-propan-2-ylpyrazole;1,5-dimethyl-4-propan-2-ylpyrazole;3,5-dimethyl-4-propan-2-yl-1H-pyrazole;4,5-dimethyl-3-propan-2-yl-2H-pyrrole;3-methyl-5-propan-2-yl-1,2-oxazole;4-methyl-5-propan-2-yl-1,2-oxazole;5-methyl-4-propan-2-yl-1,2-oxazole;1-methyl-4-propan-2-ylpyrazole;1-methyl-5-propan-2-ylpyrazole;5-methyl-4-propan-2-yl-1H-pyrazole;4-methyl-3-propan-2-yl-2H-pyrrole;5-methyl-3-propan-2-yl-2H-pyrrole;4-propan-2-yl-1,2-oxazole;5-propan-2-yl-1,2-oxazole;4-propan-2-yl-1H-pyrazole;3-propan-2-yl-2H-pyrrole;1,3,5-trimethyl-4-propan-2-ylpyrazole (CID 164989833) is 3,4-dimethyl-5-propan-2-yl-1,2-oxazole;1,4-dimethyl-5-propan-2-ylpyrazole;1,5-dimethyl-4-propan-2-ylpyrazole;3,5-dimethyl-4-propan-2-yl-1H-pyrazole;4,5-dimethyl-3-propan-2-yl-2H-pyrrole;3-methyl-5-propan-2-yl-1,2-oxazole;4-methyl-5-propan-2-yl-1,2-oxazole;5-methyl-4-propan-2-yl-1,2-oxazole;1-methyl-4-propan-2-ylpyrazole;1-methyl-5-propan-2-ylpyrazole;5-methyl-4-propan-2-yl-1H-pyrazole;4-methyl-3-propan-2-yl-2H-pyrrole;5-methyl-3-propan-2-yl-2H-pyrrole;4-propan-2-yl-1,2-oxazole;5-propan-2-yl-1,2-oxazole;4-propan-2-yl-1H-pyrazole;3-propan-2-yl-2H-pyrrole;1,3,5-trimethyl-4-propan-2-ylpyrazole.

What is the SMILES notation for 3,4-dimethyl-5-propan-2-yl-1,2-oxazole;1,4-dimethyl-5-propan-2-ylpyrazole;1,5-dimethyl-4-propan-2-ylpyrazole;3,5-dimethyl-4-propan-2-yl-1H-pyrazole;4,5-dimethyl-3-propan-2-yl-2H-pyrrole;3-methyl-5-propan-2-yl-1,2-oxazole;4-methyl-5-propan-2-yl-1,2-oxazole;5-methyl-4-propan-2-yl-1,2-oxazole;1-methyl-4-propan-2-ylpyrazole;1-methyl-5-propan-2-ylpyrazole;5-methyl-4-propan-2-yl-1H-pyrazole;4-methyl-3-propan-2-yl-2H-pyrrole;5-methyl-3-propan-2-yl-2H-pyrrole;4-propan-2-yl-1,2-oxazole;5-propan-2-yl-1,2-oxazole;4-propan-2-yl-1H-pyrazole;3-propan-2-yl-2H-pyrrole;1,3,5-trimethyl-4-propan-2-ylpyrazole?

The canonical SMILES for 3,4-dimethyl-5-propan-2-yl-1,2-oxazole;1,4-dimethyl-5-propan-2-ylpyrazole;1,5-dimethyl-4-propan-2-ylpyrazole;3,5-dimethyl-4-propan-2-yl-1H-pyrazole;4,5-dimethyl-3-propan-2-yl-2H-pyrrole;3-methyl-5-propan-2-yl-1,2-oxazole;4-methyl-5-propan-2-yl-1,2-oxazole;5-methyl-4-propan-2-yl-1,2-oxazole;1-methyl-4-propan-2-ylpyrazole;1-methyl-5-propan-2-ylpyrazole;5-methyl-4-propan-2-yl-1H-pyrazole;4-methyl-3-propan-2-yl-2H-pyrrole;5-methyl-3-propan-2-yl-2H-pyrrole;4-propan-2-yl-1,2-oxazole;5-propan-2-yl-1,2-oxazole;4-propan-2-yl-1H-pyrazole;3-propan-2-yl-2H-pyrrole;1,3,5-trimethyl-4-propan-2-ylpyrazole is CC(C)C1=CC=NC1.CC(C)c1ccnn1C.CC(C)c1ccno1.CC(C)c1cn[nH]c1.CC(C)c1cnn(C)c1.CC(C)c1cnoc1.CC1=C(C(C)C)CN=C1.CC1=NCC(C(C)C)=C1.CC1=NCC(C(C)C)=C1C.Cc1[nH]ncc1C(C)C.Cc1c(C(C)C)cnn1C.Cc1cc(C(C)C)on1.Cc1cnn(C)c1C(C)C.Cc1cnoc1C(C)C.Cc1n[nH]c(C)c1C(C)C.Cc1nn(C)c(C)c1C(C)C.Cc1noc(C(C)C)c1C.Cc1oncc1C(C)C.

What is the InChIKey of 3,4-dimethyl-5-propan-2-yl-1,2-oxazole;1,4-dimethyl-5-propan-2-ylpyrazole;1,5-dimethyl-4-propan-2-ylpyrazole;3,5-dimethyl-4-propan-2-yl-1H-pyrazole;4,5-dimethyl-3-propan-2-yl-2H-pyrrole;3-methyl-5-propan-2-yl-1,2-oxazole;4-methyl-5-propan-2-yl-1,2-oxazole;5-methyl-4-propan-2-yl-1,2-oxazole;1-methyl-4-propan-2-ylpyrazole;1-methyl-5-propan-2-ylpyrazole;5-methyl-4-propan-2-yl-1H-pyrazole;4-methyl-3-propan-2-yl-2H-pyrrole;5-methyl-3-propan-2-yl-2H-pyrrole;4-propan-2-yl-1,2-oxazole;5-propan-2-yl-1,2-oxazole;4-propan-2-yl-1H-pyrazole;3-propan-2-yl-2H-pyrrole;1,3,5-trimethyl-4-propan-2-ylpyrazole?

The InChIKey is GRQWTUQDGGOAMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N2.C9H15N.3C8H14N2.C8H13NO.2C8H13N.3C7H12N2.3C7H11NO.C7H11N.C6H10N2.2C6H9NO/c1-6(2)9-7(3)10-11(5)8(9)4;1-6(2)9-5-10-8(4)7(9)3;1-6(2)8-5-9-10(4)7(8)3;1-6(2)8-7(3)5-9-10(8)4;1-5(2)8-6(3)9-10-7(8)4;1-5(2)8-6(3)7(4)9-10-8;1-6(2)8-5-9-4-7(8)3;1-6(2)8-4-7(3)9-5-8;1-6(2)7-4-8-9(3)5-7;1-6(2)7-4-5-8-9(7)3;2*1-5(2)7-4-8-9-6(7)3;1-5(2)7-6(3)4-8-9-7;1-5(2)7-4-6(3)8-9-7;1-6(2)7-3-4-8-5-7;2*1-5(2)6-3-7-8-4-6;1-5(2)6-3-4-7-8-6/h6H,1-5H3;6H,5H2,1-4H3;2*5-6H,1-4H3;5H,1-4H3,(H,9,10);5H,1-4H3;2*4,6H,5H2,1-3H3;2*4-6H,1-3H3;4-5H,1-3H3,(H,8,9);3*4-5H,1-3H3;3-4,6H,5H2,1-2H3;3-5H,1-2H3,(H,7,8);2*3-5H,1-2H3.

What are the key properties of 3,4-dimethyl-5-propan-2-yl-1,2-oxazole;1,4-dimethyl-5-propan-2-ylpyrazole;1,5-dimethyl-4-propan-2-ylpyrazole;3,5-dimethyl-4-propan-2-yl-1H-pyrazole;4,5-dimethyl-3-propan-2-yl-2H-pyrrole;3-methyl-5-propan-2-yl-1,2-oxazole;4-methyl-5-propan-2-yl-1,2-oxazole;5-methyl-4-propan-2-yl-1,2-oxazole;1-methyl-4-propan-2-ylpyrazole;1-methyl-5-propan-2-ylpyrazole;5-methyl-4-propan-2-yl-1H-pyrazole;4-methyl-3-propan-2-yl-2H-pyrrole;5-methyl-3-propan-2-yl-2H-pyrrole;4-propan-2-yl-1,2-oxazole;5-propan-2-yl-1,2-oxazole;4-propan-2-yl-1H-pyrazole;3-propan-2-yl-2H-pyrrole;1,3,5-trimethyl-4-propan-2-ylpyrazole?

3,4-dimethyl-5-propan-2-yl-1,2-oxazole;1,4-dimethyl-5-propan-2-ylpyrazole;1,5-dimethyl-4-propan-2-ylpyrazole;3,5-dimethyl-4-propan-2-yl-1H-pyrazole;4,5-dimethyl-3-propan-2-yl-2H-pyrrole;3-methyl-5-propan-2-yl-1,2-oxazole;4-methyl-5-propan-2-yl-1,2-oxazole;5-methyl-4-propan-2-yl-1,2-oxazole;1-methyl-4-propan-2-ylpyrazole;1-methyl-5-propan-2-ylpyrazole;5-methyl-4-propan-2-yl-1H-pyrazole;4-methyl-3-propan-2-yl-2H-pyrrole;5-methyl-3-propan-2-yl-2H-pyrrole;4-propan-2-yl-1,2-oxazole;5-propan-2-yl-1,2-oxazole;4-propan-2-yl-1H-pyrazole;3-propan-2-yl-2H-pyrrole;1,3,5-trimethyl-4-propan-2-ylpyrazole has a molecular weight of 2279.40 g/mol, XLogP of 34.98, 18 rotatable bonds, 3 hydrogen bond donors, and 29 hydrogen bond acceptors.

Where does this data come from?

All data for 3,4-dimethyl-5-propan-2-yl-1,2-oxazole;1,4-dimethyl-5-propan-2-ylpyrazole;1,5-dimethyl-4-propan-2-ylpyrazole;3,5-dimethyl-4-propan-2-yl-1H-pyrazole;4,5-dimethyl-3-propan-2-yl-2H-pyrrole;3-methyl-5-propan-2-yl-1,2-oxazole;4-methyl-5-propan-2-yl-1,2-oxazole;5-methyl-4-propan-2-yl-1,2-oxazole;1-methyl-4-propan-2-ylpyrazole;1-methyl-5-propan-2-ylpyrazole;5-methyl-4-propan-2-yl-1H-pyrazole;4-methyl-3-propan-2-yl-2H-pyrrole;5-methyl-3-propan-2-yl-2H-pyrrole;4-propan-2-yl-1,2-oxazole;5-propan-2-yl-1,2-oxazole;4-propan-2-yl-1H-pyrazole;3-propan-2-yl-2H-pyrrole;1,3,5-trimethyl-4-propan-2-ylpyrazole is sourced from PubChem (CID 164989833), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).