3-ethyl-1,2-oxazole;4-ethyl-1,2-oxazole;5-ethyl-1,2-oxazole;3-propan-2-yl-1,2-oxazole;4-propan-2-yl-1,2-oxazole;5-propan-2-yl-1,2-oxazole;2-propylfuran;3-propyl-1,2-oxazole;4-propyl-1,2-oxazole

C52H76N8O9 — CID 160705392

About 3-ethyl-1,2-oxazole;4-ethyl-1,2-oxazole;5-ethyl-1,2-oxazole;3-propan-2-yl-1,2-oxazole;4-propan-2-yl-1,2-oxazole;5-propan-2-yl-1,2-oxazole;2-propylfuran;3-propyl-1,2-oxazole;4-propyl-1,2-oxazole

3-ethyl-1,2-oxazole;4-ethyl-1,2-oxazole;5-ethyl-1,2-oxazole;3-propan-2-yl-1,2-oxazole;4-propan-2-yl-1,2-oxazole;5-propan-2-yl-1,2-oxazole;2-propylfuran;3-propyl-1,2-oxazole;4-propyl-1,2-oxazole (PubChem CID 160705392) has the molecular formula C52H76N8O9 and a molecular weight of 957.23 g/mol. Its IUPAC name is 3-ethyl-1,2-oxazole;4-ethyl-1,2-oxazole;5-ethyl-1,2-oxazole;3-propan-2-yl-1,2-oxazole;4-propan-2-yl-1,2-oxazole;5-propan-2-yl-1,2-oxazole;2-propylfuran;3-propyl-1,2-oxazole;4-propyl-1,2-oxazole.

Molecular Properties

• Compound Name: 3-ethyl-1,2-oxazole;4-ethyl-1,2-oxazole;5-ethyl-1,2-oxazole;3-propan-2-yl-1,2-oxazole;4-propan-2-yl-1,2-oxazole;5-propan-2-yl-1,2-oxazole;2-propylfuran;3-propyl-1,2-oxazole;4-propyl-1,2-oxazole
• PubChem CID: 160705392
• Molecular Formula: C52H76N8O9
• Molecular Weight: 957.23 g/mol
• Exact Mass: 956.57
• IUPAC Name: 3-ethyl-1,2-oxazole;4-ethyl-1,2-oxazole;5-ethyl-1,2-oxazole;3-propan-2-yl-1,2-oxazole;4-propan-2-yl-1,2-oxazole;5-propan-2-yl-1,2-oxazole;2-propylfuran;3-propyl-1,2-oxazole;4-propyl-1,2-oxazole
• SMILES: CC(C)c1ccno1.CC(C)c1ccon1.CC(C)c1cnoc1.CCCc1ccco1.CCCc1ccon1.CCCc1cnoc1.CCc1ccno1.CCc1ccon1.CCc1cnoc1
• InChI: InChI=1S/C7H10O.5C6H9NO.3C5H7NO/c1-2-4-7-5-3-6-8-7;1-5(2)6-3-7-8-4-6;1-5(2)6-3-4-8-7-6;1-5(2)6-3-4-7-8-6;1-2-3-6-4-7-8-5-6;1-2-3-6-4-5-8-7-6;1-2-5-3-6-7-4-5;1-2-5-3-4-7-6-5;1-2-5-3-4-6-7-5/h3,5-6H,2,4H2,1H3;3*3-5H,1-2H3;2*4-5H,2-3H2,1H3;3*3-4H,2H2,1H3
• InChIKey: RRDSCVBQVYXZSF-UHFFFAOYSA-N
• XLogP: 14.59
• TPSA: 221.38 Ų
• H-Bond Acceptors: 17
• Rotatable Bonds: 12
• Heavy Atoms: 69
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	957.23
LogP ≤ 5	14.59
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	17

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-1,2-oxazole;4-ethyl-1,2-oxazole;5-ethyl-1,2-oxazole;3-propan-2-yl-1,2-oxazole;4-propan-2-yl-1,2-oxazole;5-propan-2-yl-1,2-oxazole;2-propylfuran;3-propyl-1,2-oxazole;4-propyl-1,2-oxazole?

The IUPAC name of 3-ethyl-1,2-oxazole;4-ethyl-1,2-oxazole;5-ethyl-1,2-oxazole;3-propan-2-yl-1,2-oxazole;4-propan-2-yl-1,2-oxazole;5-propan-2-yl-1,2-oxazole;2-propylfuran;3-propyl-1,2-oxazole;4-propyl-1,2-oxazole (CID 160705392) is 3-ethyl-1,2-oxazole;4-ethyl-1,2-oxazole;5-ethyl-1,2-oxazole;3-propan-2-yl-1,2-oxazole;4-propan-2-yl-1,2-oxazole;5-propan-2-yl-1,2-oxazole;2-propylfuran;3-propyl-1,2-oxazole;4-propyl-1,2-oxazole.

What is the SMILES notation for 3-ethyl-1,2-oxazole;4-ethyl-1,2-oxazole;5-ethyl-1,2-oxazole;3-propan-2-yl-1,2-oxazole;4-propan-2-yl-1,2-oxazole;5-propan-2-yl-1,2-oxazole;2-propylfuran;3-propyl-1,2-oxazole;4-propyl-1,2-oxazole?

The canonical SMILES for 3-ethyl-1,2-oxazole;4-ethyl-1,2-oxazole;5-ethyl-1,2-oxazole;3-propan-2-yl-1,2-oxazole;4-propan-2-yl-1,2-oxazole;5-propan-2-yl-1,2-oxazole;2-propylfuran;3-propyl-1,2-oxazole;4-propyl-1,2-oxazole is CC(C)c1ccno1.CC(C)c1ccon1.CC(C)c1cnoc1.CCCc1ccco1.CCCc1ccon1.CCCc1cnoc1.CCc1ccno1.CCc1ccon1.CCc1cnoc1.

What is the InChIKey of 3-ethyl-1,2-oxazole;4-ethyl-1,2-oxazole;5-ethyl-1,2-oxazole;3-propan-2-yl-1,2-oxazole;4-propan-2-yl-1,2-oxazole;5-propan-2-yl-1,2-oxazole;2-propylfuran;3-propyl-1,2-oxazole;4-propyl-1,2-oxazole?

The InChIKey is RRDSCVBQVYXZSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10O.5C6H9NO.3C5H7NO/c1-2-4-7-5-3-6-8-7;1-5(2)6-3-7-8-4-6;1-5(2)6-3-4-8-7-6;1-5(2)6-3-4-7-8-6;1-2-3-6-4-7-8-5-6;1-2-3-6-4-5-8-7-6;1-2-5-3-6-7-4-5;1-2-5-3-4-7-6-5;1-2-5-3-4-6-7-5/h3,5-6H,2,4H2,1H3;3*3-5H,1-2H3;2*4-5H,2-3H2,1H3;3*3-4H,2H2,1H3.

What are the key properties of 3-ethyl-1,2-oxazole;4-ethyl-1,2-oxazole;5-ethyl-1,2-oxazole;3-propan-2-yl-1,2-oxazole;4-propan-2-yl-1,2-oxazole;5-propan-2-yl-1,2-oxazole;2-propylfuran;3-propyl-1,2-oxazole;4-propyl-1,2-oxazole?

3-ethyl-1,2-oxazole;4-ethyl-1,2-oxazole;5-ethyl-1,2-oxazole;3-propan-2-yl-1,2-oxazole;4-propan-2-yl-1,2-oxazole;5-propan-2-yl-1,2-oxazole;2-propylfuran;3-propyl-1,2-oxazole;4-propyl-1,2-oxazole has a molecular weight of 957.23 g/mol, XLogP of 14.59, 12 rotatable bonds, 0 hydrogen bond donors, and 17 hydrogen bond acceptors.

Where does this data come from?

All data for 3-ethyl-1,2-oxazole;4-ethyl-1,2-oxazole;5-ethyl-1,2-oxazole;3-propan-2-yl-1,2-oxazole;4-propan-2-yl-1,2-oxazole;5-propan-2-yl-1,2-oxazole;2-propylfuran;3-propyl-1,2-oxazole;4-propyl-1,2-oxazole is sourced from PubChem (CID 160705392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).