3-propan-2-ylfuran;bis(2-propan-2-yl-4H-imidazole);bis(3-propan-2-yl-1,2,4-oxadiazole);bis(5-propan-2-yl-1,2,4-oxadiazole);bis(3-propan-2-yl-1,2-oxazole);4-propan-2-yl-1,3-oxazole;bis(5-propan-2-yl-1,2-oxazole);5-propan-2-yl-2H-pyrrole;bis(3-propan-2-yl-1,2,4-thiadiazole);bis(5-propan-2-yl-1,2,4-thiadiazole);bis(3-propan-2-yl-1,2-thiazole);4-propan-2-yl-1,3-thiazole;bis(5-propan-2-yl-1,2-thiazole);3-propan-2-ylthiophene;bis(5-propan-2-yl-1H-1,2,4-triazole)

C143H223N37O10S10 — CID 158507661

About 3-propan-2-ylfuran;bis(2-propan-2-yl-4H-imidazole);bis(3-propan-2-yl-1,2,4-oxadiazole);bis(5-propan-2-yl-1,2,4-oxadiazole);bis(3-propan-2-yl-1,2-oxazole);4-propan-2-yl-1,3-oxazole;bis(5-propan-2-yl-1,2-oxazole);5-propan-2-yl-2H-pyrrole;bis(3-propan-2-yl-1,2,4-thiadiazole);bis(5-propan-2-yl-1,2,4-thiadiazole);bis(3-propan-2-yl-1,2-thiazole);4-propan-2-yl-1,3-thiazole;bis(5-propan-2-yl-1,2-thiazole);3-propan-2-ylthiophene;bis(5-propan-2-yl-1H-1,2,4-triazole)

3-propan-2-ylfuran;bis(2-propan-2-yl-4H-imidazole);bis(3-propan-2-yl-1,2,4-oxadiazole);bis(5-propan-2-yl-1,2,4-oxadiazole);bis(3-propan-2-yl-1,2-oxazole);4-propan-2-yl-1,3-oxazole;bis(5-propan-2-yl-1,2-oxazole);5-propan-2-yl-2H-pyrrole;bis(3-propan-2-yl-1,2,4-thiadiazole);bis(5-propan-2-yl-1,2,4-thiadiazole);bis(3-propan-2-yl-1,2-thiazole);4-propan-2-yl-1,3-thiazole;bis(5-propan-2-yl-1,2-thiazole);3-propan-2-ylthiophene;bis(5-propan-2-yl-1H-1,2,4-triazole) (PubChem CID 158507661) has the molecular formula C143H223N37O10S10 and a molecular weight of 2941.28 g/mol. Its IUPAC name is 3-propan-2-ylfuran;bis(2-propan-2-yl-4H-imidazole);bis(3-propan-2-yl-1,2,4-oxadiazole);bis(5-propan-2-yl-1,2,4-oxadiazole);bis(3-propan-2-yl-1,2-oxazole);4-propan-2-yl-1,3-oxazole;bis(5-propan-2-yl-1,2-oxazole);5-propan-2-yl-2H-pyrrole;bis(3-propan-2-yl-1,2,4-thiadiazole);bis(5-propan-2-yl-1,2,4-thiadiazole);bis(3-propan-2-yl-1,2-thiazole);4-propan-2-yl-1,3-thiazole;bis(5-propan-2-yl-1,2-thiazole);3-propan-2-ylthiophene;bis(5-propan-2-yl-1H-1,2,4-triazole).

Molecular Properties

• Compound Name: 3-propan-2-ylfuran;bis(2-propan-2-yl-4H-imidazole);bis(3-propan-2-yl-1,2,4-oxadiazole);bis(5-propan-2-yl-1,2,4-oxadiazole);bis(3-propan-2-yl-1,2-oxazole);4-propan-2-yl-1,3-oxazole;bis(5-propan-2-yl-1,2-oxazole);5-propan-2-yl-2H-pyrrole;bis(3-propan-2-yl-1,2,4-thiadiazole);bis(5-propan-2-yl-1,2,4-thiadiazole);bis(3-propan-2-yl-1,2-thiazole);4-propan-2-yl-1,3-thiazole;bis(5-propan-2-yl-1,2-thiazole);3-propan-2-ylthiophene;bis(5-propan-2-yl-1H-1,2,4-triazole)
• PubChem CID: 158507661
• Molecular Formula: C143H223N37O10S10
• Molecular Weight: 2941.28 g/mol
• Exact Mass: 2938.53
• IUPAC Name: 3-propan-2-ylfuran;bis(2-propan-2-yl-4H-imidazole);bis(3-propan-2-yl-1,2,4-oxadiazole);bis(5-propan-2-yl-1,2,4-oxadiazole);bis(3-propan-2-yl-1,2-oxazole);4-propan-2-yl-1,3-oxazole;bis(5-propan-2-yl-1,2-oxazole);5-propan-2-yl-2H-pyrrole;bis(3-propan-2-yl-1,2,4-thiadiazole);bis(5-propan-2-yl-1,2,4-thiadiazole);bis(3-propan-2-yl-1,2-thiazole);4-propan-2-yl-1,3-thiazole;bis(5-propan-2-yl-1,2-thiazole);3-propan-2-ylthiophene;bis(5-propan-2-yl-1H-1,2,4-triazole)
• SMILES: CC(C)C1=NCC=C1.CC(C)C1=NCC=N1.CC(C)C1=NCC=N1.CC(C)c1ccno1.CC(C)c1ccno1.CC(C)c1ccns1.CC(C)c1ccns1.CC(C)c1ccoc1.CC(C)c1ccon1.CC(C)c1ccon1.CC(C)c1ccsc1.CC(C)c1ccsn1.CC(C)c1ccsn1.CC(C)c1cocn1.CC(C)c1cscn1.CC(C)c1ncn[nH]1.CC(C)c1ncn[nH]1.CC(C)c1ncno1.CC(C)c1ncno1.CC(C)c1ncns1.CC(C)c1ncns1.CC(C)c1ncon1.CC(C)c1ncon1.CC(C)c1ncsn1.CC(C)c1ncsn1
• InChI: InChI=1S/C7H11N.C7H10O.C7H10S.2C6H10N2.5C6H9NO.5C6H9NS.2C5H9N3.4C5H8N2O.4C5H8N2S/c1-6(2)7-4-3-5-8-7;2*1-6(2)7-3-4-8-5-7;2*1-5(2)6-7-3-4-8-6;1-5(2)6-3-8-4-7-6;2*1-5(2)6-3-4-8-7-6;2*1-5(2)6-3-4-7-8-6;1-5(2)6-3-8-4-7-6;2*1-5(2)6-3-4-8-7-6;2*1-5(2)6-3-4-7-8-6;2*1-4(2)5-6-3-7-8-5;2*1-4(2)5-6-3-8-7-5;2*1-4(2)5-6-3-7-8-5;2*1-4(2)5-6-3-8-7-5;2*1-4(2)5-6-3-7-8-5/h3-4,6H,5H2,1-2H3;2*3-6H,1-2H3;2*3,5H,4H2,1-2H3;10*3-5H,1-2H3;2*3-4H,1-2H3,(H,6,7,8);8*3-4H,1-2H3
• InChIKey: HKQOTQXIYBJARZ-UHFFFAOYSA-N
• XLogP: 42.78
• TPSA: 611.48 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 55
• Rotatable Bonds: 25
• Heavy Atoms: 200
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2941.28
LogP ≤ 5	42.78
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	55

Frequently Asked Questions

What is the IUPAC name of 3-propan-2-ylfuran;bis(2-propan-2-yl-4H-imidazole);bis(3-propan-2-yl-1,2,4-oxadiazole);bis(5-propan-2-yl-1,2,4-oxadiazole);bis(3-propan-2-yl-1,2-oxazole);4-propan-2-yl-1,3-oxazole;bis(5-propan-2-yl-1,2-oxazole);5-propan-2-yl-2H-pyrrole;bis(3-propan-2-yl-1,2,4-thiadiazole);bis(5-propan-2-yl-1,2,4-thiadiazole);bis(3-propan-2-yl-1,2-thiazole);4-propan-2-yl-1,3-thiazole;bis(5-propan-2-yl-1,2-thiazole);3-propan-2-ylthiophene;bis(5-propan-2-yl-1H-1,2,4-triazole)?

The IUPAC name of 3-propan-2-ylfuran;bis(2-propan-2-yl-4H-imidazole);bis(3-propan-2-yl-1,2,4-oxadiazole);bis(5-propan-2-yl-1,2,4-oxadiazole);bis(3-propan-2-yl-1,2-oxazole);4-propan-2-yl-1,3-oxazole;bis(5-propan-2-yl-1,2-oxazole);5-propan-2-yl-2H-pyrrole;bis(3-propan-2-yl-1,2,4-thiadiazole);bis(5-propan-2-yl-1,2,4-thiadiazole);bis(3-propan-2-yl-1,2-thiazole);4-propan-2-yl-1,3-thiazole;bis(5-propan-2-yl-1,2-thiazole);3-propan-2-ylthiophene;bis(5-propan-2-yl-1H-1,2,4-triazole) (CID 158507661) is 3-propan-2-ylfuran;bis(2-propan-2-yl-4H-imidazole);bis(3-propan-2-yl-1,2,4-oxadiazole);bis(5-propan-2-yl-1,2,4-oxadiazole);bis(3-propan-2-yl-1,2-oxazole);4-propan-2-yl-1,3-oxazole;bis(5-propan-2-yl-1,2-oxazole);5-propan-2-yl-2H-pyrrole;bis(3-propan-2-yl-1,2,4-thiadiazole);bis(5-propan-2-yl-1,2,4-thiadiazole);bis(3-propan-2-yl-1,2-thiazole);4-propan-2-yl-1,3-thiazole;bis(5-propan-2-yl-1,2-thiazole);3-propan-2-ylthiophene;bis(5-propan-2-yl-1H-1,2,4-triazole).

What is the SMILES notation for 3-propan-2-ylfuran;bis(2-propan-2-yl-4H-imidazole);bis(3-propan-2-yl-1,2,4-oxadiazole);bis(5-propan-2-yl-1,2,4-oxadiazole);bis(3-propan-2-yl-1,2-oxazole);4-propan-2-yl-1,3-oxazole;bis(5-propan-2-yl-1,2-oxazole);5-propan-2-yl-2H-pyrrole;bis(3-propan-2-yl-1,2,4-thiadiazole);bis(5-propan-2-yl-1,2,4-thiadiazole);bis(3-propan-2-yl-1,2-thiazole);4-propan-2-yl-1,3-thiazole;bis(5-propan-2-yl-1,2-thiazole);3-propan-2-ylthiophene;bis(5-propan-2-yl-1H-1,2,4-triazole)?

The canonical SMILES for 3-propan-2-ylfuran;bis(2-propan-2-yl-4H-imidazole);bis(3-propan-2-yl-1,2,4-oxadiazole);bis(5-propan-2-yl-1,2,4-oxadiazole);bis(3-propan-2-yl-1,2-oxazole);4-propan-2-yl-1,3-oxazole;bis(5-propan-2-yl-1,2-oxazole);5-propan-2-yl-2H-pyrrole;bis(3-propan-2-yl-1,2,4-thiadiazole);bis(5-propan-2-yl-1,2,4-thiadiazole);bis(3-propan-2-yl-1,2-thiazole);4-propan-2-yl-1,3-thiazole;bis(5-propan-2-yl-1,2-thiazole);3-propan-2-ylthiophene;bis(5-propan-2-yl-1H-1,2,4-triazole) is CC(C)C1=NCC=C1.CC(C)C1=NCC=N1.CC(C)C1=NCC=N1.CC(C)c1ccno1.CC(C)c1ccno1.CC(C)c1ccns1.CC(C)c1ccns1.CC(C)c1ccoc1.CC(C)c1ccon1.CC(C)c1ccon1.CC(C)c1ccsc1.CC(C)c1ccsn1.CC(C)c1ccsn1.CC(C)c1cocn1.CC(C)c1cscn1.CC(C)c1ncn[nH]1.CC(C)c1ncn[nH]1.CC(C)c1ncno1.CC(C)c1ncno1.CC(C)c1ncns1.CC(C)c1ncns1.CC(C)c1ncon1.CC(C)c1ncon1.CC(C)c1ncsn1.CC(C)c1ncsn1.

What is the InChIKey of 3-propan-2-ylfuran;bis(2-propan-2-yl-4H-imidazole);bis(3-propan-2-yl-1,2,4-oxadiazole);bis(5-propan-2-yl-1,2,4-oxadiazole);bis(3-propan-2-yl-1,2-oxazole);4-propan-2-yl-1,3-oxazole;bis(5-propan-2-yl-1,2-oxazole);5-propan-2-yl-2H-pyrrole;bis(3-propan-2-yl-1,2,4-thiadiazole);bis(5-propan-2-yl-1,2,4-thiadiazole);bis(3-propan-2-yl-1,2-thiazole);4-propan-2-yl-1,3-thiazole;bis(5-propan-2-yl-1,2-thiazole);3-propan-2-ylthiophene;bis(5-propan-2-yl-1H-1,2,4-triazole)?

The InChIKey is HKQOTQXIYBJARZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N.C7H10O.C7H10S.2C6H10N2.5C6H9NO.5C6H9NS.2C5H9N3.4C5H8N2O.4C5H8N2S/c1-6(2)7-4-3-5-8-7;2*1-6(2)7-3-4-8-5-7;2*1-5(2)6-7-3-4-8-6;1-5(2)6-3-8-4-7-6;2*1-5(2)6-3-4-8-7-6;2*1-5(2)6-3-4-7-8-6;1-5(2)6-3-8-4-7-6;2*1-5(2)6-3-4-8-7-6;2*1-5(2)6-3-4-7-8-6;2*1-4(2)5-6-3-7-8-5;2*1-4(2)5-6-3-8-7-5;2*1-4(2)5-6-3-7-8-5;2*1-4(2)5-6-3-8-7-5;2*1-4(2)5-6-3-7-8-5/h3-4,6H,5H2,1-2H3;2*3-6H,1-2H3;2*3,5H,4H2,1-2H3;10*3-5H,1-2H3;2*3-4H,1-2H3,(H,6,7,8);8*3-4H,1-2H3.

What are the key properties of 3-propan-2-ylfuran;bis(2-propan-2-yl-4H-imidazole);bis(3-propan-2-yl-1,2,4-oxadiazole);bis(5-propan-2-yl-1,2,4-oxadiazole);bis(3-propan-2-yl-1,2-oxazole);4-propan-2-yl-1,3-oxazole;bis(5-propan-2-yl-1,2-oxazole);5-propan-2-yl-2H-pyrrole;bis(3-propan-2-yl-1,2,4-thiadiazole);bis(5-propan-2-yl-1,2,4-thiadiazole);bis(3-propan-2-yl-1,2-thiazole);4-propan-2-yl-1,3-thiazole;bis(5-propan-2-yl-1,2-thiazole);3-propan-2-ylthiophene;bis(5-propan-2-yl-1H-1,2,4-triazole)?

3-propan-2-ylfuran;bis(2-propan-2-yl-4H-imidazole);bis(3-propan-2-yl-1,2,4-oxadiazole);bis(5-propan-2-yl-1,2,4-oxadiazole);bis(3-propan-2-yl-1,2-oxazole);4-propan-2-yl-1,3-oxazole;bis(5-propan-2-yl-1,2-oxazole);5-propan-2-yl-2H-pyrrole;bis(3-propan-2-yl-1,2,4-thiadiazole);bis(5-propan-2-yl-1,2,4-thiadiazole);bis(3-propan-2-yl-1,2-thiazole);4-propan-2-yl-1,3-thiazole;bis(5-propan-2-yl-1,2-thiazole);3-propan-2-ylthiophene;bis(5-propan-2-yl-1H-1,2,4-triazole) has a molecular weight of 2941.28 g/mol, XLogP of 42.78, 25 rotatable bonds, 2 hydrogen bond donors, and 55 hydrogen bond acceptors.

Where does this data come from?

All data for 3-propan-2-ylfuran;bis(2-propan-2-yl-4H-imidazole);bis(3-propan-2-yl-1,2,4-oxadiazole);bis(5-propan-2-yl-1,2,4-oxadiazole);bis(3-propan-2-yl-1,2-oxazole);4-propan-2-yl-1,3-oxazole;bis(5-propan-2-yl-1,2-oxazole);5-propan-2-yl-2H-pyrrole;bis(3-propan-2-yl-1,2,4-thiadiazole);bis(5-propan-2-yl-1,2,4-thiadiazole);bis(3-propan-2-yl-1,2-thiazole);4-propan-2-yl-1,3-thiazole;bis(5-propan-2-yl-1,2-thiazole);3-propan-2-ylthiophene;bis(5-propan-2-yl-1H-1,2,4-triazole) is sourced from PubChem (CID 158507661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).