2-cyclobutyl-5-methyl-1,3-oxazole;2-cyclopropyl-5-methyl-1,3-oxazole;3-ethyl-1,2,4-oxadiazole;3-methyl-1,2,4-oxadiazole;5-methyl-2-pyridin-2-yl-1,3-oxazole;5-methyl-2-pyridin-3-yl-1,3-oxazole;2-methyl-5-(trifluoromethyl)-1,3-oxazole;1,2,4-oxadiazole;3-propan-2-yl-1,2,4-oxadiazole

C52H60F3N15O9 — CID 158500208

About 2-cyclobutyl-5-methyl-1,3-oxazole;2-cyclopropyl-5-methyl-1,3-oxazole;3-ethyl-1,2,4-oxadiazole;3-methyl-1,2,4-oxadiazole;5-methyl-2-pyridin-2-yl-1,3-oxazole;5-methyl-2-pyridin-3-yl-1,3-oxazole;2-methyl-5-(trifluoromethyl)-1,3-oxazole;1,2,4-oxadiazole;3-propan-2-yl-1,2,4-oxadiazole

2-cyclobutyl-5-methyl-1,3-oxazole;2-cyclopropyl-5-methyl-1,3-oxazole;3-ethyl-1,2,4-oxadiazole;3-methyl-1,2,4-oxadiazole;5-methyl-2-pyridin-2-yl-1,3-oxazole;5-methyl-2-pyridin-3-yl-1,3-oxazole;2-methyl-5-(trifluoromethyl)-1,3-oxazole;1,2,4-oxadiazole;3-propan-2-yl-1,2,4-oxadiazole (PubChem CID 158500208) has the molecular formula C52H60F3N15O9 and a molecular weight of 1096.14 g/mol. Its IUPAC name is 2-cyclobutyl-5-methyl-1,3-oxazole;2-cyclopropyl-5-methyl-1,3-oxazole;3-ethyl-1,2,4-oxadiazole;3-methyl-1,2,4-oxadiazole;5-methyl-2-pyridin-2-yl-1,3-oxazole;5-methyl-2-pyridin-3-yl-1,3-oxazole;2-methyl-5-(trifluoromethyl)-1,3-oxazole;1,2,4-oxadiazole;3-propan-2-yl-1,2,4-oxadiazole.

Molecular Properties

• Compound Name: 2-cyclobutyl-5-methyl-1,3-oxazole;2-cyclopropyl-5-methyl-1,3-oxazole;3-ethyl-1,2,4-oxadiazole;3-methyl-1,2,4-oxadiazole;5-methyl-2-pyridin-2-yl-1,3-oxazole;5-methyl-2-pyridin-3-yl-1,3-oxazole;2-methyl-5-(trifluoromethyl)-1,3-oxazole;1,2,4-oxadiazole;3-propan-2-yl-1,2,4-oxadiazole
• PubChem CID: 158500208
• Molecular Formula: C52H60F3N15O9
• Molecular Weight: 1096.14 g/mol
• Exact Mass: 1095.47
• IUPAC Name: 2-cyclobutyl-5-methyl-1,3-oxazole;2-cyclopropyl-5-methyl-1,3-oxazole;3-ethyl-1,2,4-oxadiazole;3-methyl-1,2,4-oxadiazole;5-methyl-2-pyridin-2-yl-1,3-oxazole;5-methyl-2-pyridin-3-yl-1,3-oxazole;2-methyl-5-(trifluoromethyl)-1,3-oxazole;1,2,4-oxadiazole;3-propan-2-yl-1,2,4-oxadiazole
• SMILES: CC(C)c1ncon1.CCc1ncon1.Cc1cnc(-c2ccccn2)o1.Cc1cnc(-c2cccnc2)o1.Cc1cnc(C2CC2)o1.Cc1cnc(C2CCC2)o1.Cc1ncc(C(F)(F)F)o1.Cc1ncon1.c1ncon1
• InChI: InChI=1S/2C9H8N2O.C8H11NO.C7H9NO.C5H4F3NO.C5H8N2O.C4H6N2O.C3H4N2O.C2H2N2O/c1-7-5-11-9(12-7)8-3-2-4-10-6-8;1-7-6-11-9(12-7)8-4-2-3-5-10-8;1-6-5-9-8(10-6)7-3-2-4-7;1-5-4-8-7(9-5)6-2-3-6;1-3-9-2-4(10-3)5(6,7)8;1-4(2)5-6-3-8-7-5;1-2-4-5-3-7-6-4;1-3-4-2-6-5-3;1-3-2-5-4-1/h2*2-6H,1H3;5,7H,2-4H2,1H3;4,6H,2-3H2,1H3;2H,1H3;3-4H,1-2H3;3H,2H2,1H3;2H,1H3;1-2H
• InChIKey: HJUHKQQGSCENIR-UHFFFAOYSA-N
• XLogP: 12.48
• TPSA: 311.61 Ų
• H-Bond Acceptors: 24
• Rotatable Bonds: 6
• Heavy Atoms: 79
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1096.14
LogP ≤ 5	12.48
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	24

Frequently Asked Questions

What is the IUPAC name of 2-cyclobutyl-5-methyl-1,3-oxazole;2-cyclopropyl-5-methyl-1,3-oxazole;3-ethyl-1,2,4-oxadiazole;3-methyl-1,2,4-oxadiazole;5-methyl-2-pyridin-2-yl-1,3-oxazole;5-methyl-2-pyridin-3-yl-1,3-oxazole;2-methyl-5-(trifluoromethyl)-1,3-oxazole;1,2,4-oxadiazole;3-propan-2-yl-1,2,4-oxadiazole?

The IUPAC name of 2-cyclobutyl-5-methyl-1,3-oxazole;2-cyclopropyl-5-methyl-1,3-oxazole;3-ethyl-1,2,4-oxadiazole;3-methyl-1,2,4-oxadiazole;5-methyl-2-pyridin-2-yl-1,3-oxazole;5-methyl-2-pyridin-3-yl-1,3-oxazole;2-methyl-5-(trifluoromethyl)-1,3-oxazole;1,2,4-oxadiazole;3-propan-2-yl-1,2,4-oxadiazole (CID 158500208) is 2-cyclobutyl-5-methyl-1,3-oxazole;2-cyclopropyl-5-methyl-1,3-oxazole;3-ethyl-1,2,4-oxadiazole;3-methyl-1,2,4-oxadiazole;5-methyl-2-pyridin-2-yl-1,3-oxazole;5-methyl-2-pyridin-3-yl-1,3-oxazole;2-methyl-5-(trifluoromethyl)-1,3-oxazole;1,2,4-oxadiazole;3-propan-2-yl-1,2,4-oxadiazole.

What is the SMILES notation for 2-cyclobutyl-5-methyl-1,3-oxazole;2-cyclopropyl-5-methyl-1,3-oxazole;3-ethyl-1,2,4-oxadiazole;3-methyl-1,2,4-oxadiazole;5-methyl-2-pyridin-2-yl-1,3-oxazole;5-methyl-2-pyridin-3-yl-1,3-oxazole;2-methyl-5-(trifluoromethyl)-1,3-oxazole;1,2,4-oxadiazole;3-propan-2-yl-1,2,4-oxadiazole?

The canonical SMILES for 2-cyclobutyl-5-methyl-1,3-oxazole;2-cyclopropyl-5-methyl-1,3-oxazole;3-ethyl-1,2,4-oxadiazole;3-methyl-1,2,4-oxadiazole;5-methyl-2-pyridin-2-yl-1,3-oxazole;5-methyl-2-pyridin-3-yl-1,3-oxazole;2-methyl-5-(trifluoromethyl)-1,3-oxazole;1,2,4-oxadiazole;3-propan-2-yl-1,2,4-oxadiazole is CC(C)c1ncon1.CCc1ncon1.Cc1cnc(-c2ccccn2)o1.Cc1cnc(-c2cccnc2)o1.Cc1cnc(C2CC2)o1.Cc1cnc(C2CCC2)o1.Cc1ncc(C(F)(F)F)o1.Cc1ncon1.c1ncon1.

What is the InChIKey of 2-cyclobutyl-5-methyl-1,3-oxazole;2-cyclopropyl-5-methyl-1,3-oxazole;3-ethyl-1,2,4-oxadiazole;3-methyl-1,2,4-oxadiazole;5-methyl-2-pyridin-2-yl-1,3-oxazole;5-methyl-2-pyridin-3-yl-1,3-oxazole;2-methyl-5-(trifluoromethyl)-1,3-oxazole;1,2,4-oxadiazole;3-propan-2-yl-1,2,4-oxadiazole?

The InChIKey is HJUHKQQGSCENIR-UHFFFAOYSA-N. The full InChI is InChI=1S/2C9H8N2O.C8H11NO.C7H9NO.C5H4F3NO.C5H8N2O.C4H6N2O.C3H4N2O.C2H2N2O/c1-7-5-11-9(12-7)8-3-2-4-10-6-8;1-7-6-11-9(12-7)8-4-2-3-5-10-8;1-6-5-9-8(10-6)7-3-2-4-7;1-5-4-8-7(9-5)6-2-3-6;1-3-9-2-4(10-3)5(6,7)8;1-4(2)5-6-3-8-7-5;1-2-4-5-3-7-6-4;1-3-4-2-6-5-3;1-3-2-5-4-1/h2*2-6H,1H3;5,7H,2-4H2,1H3;4,6H,2-3H2,1H3;2H,1H3;3-4H,1-2H3;3H,2H2,1H3;2H,1H3;1-2H.

What are the key properties of 2-cyclobutyl-5-methyl-1,3-oxazole;2-cyclopropyl-5-methyl-1,3-oxazole;3-ethyl-1,2,4-oxadiazole;3-methyl-1,2,4-oxadiazole;5-methyl-2-pyridin-2-yl-1,3-oxazole;5-methyl-2-pyridin-3-yl-1,3-oxazole;2-methyl-5-(trifluoromethyl)-1,3-oxazole;1,2,4-oxadiazole;3-propan-2-yl-1,2,4-oxadiazole?

2-cyclobutyl-5-methyl-1,3-oxazole;2-cyclopropyl-5-methyl-1,3-oxazole;3-ethyl-1,2,4-oxadiazole;3-methyl-1,2,4-oxadiazole;5-methyl-2-pyridin-2-yl-1,3-oxazole;5-methyl-2-pyridin-3-yl-1,3-oxazole;2-methyl-5-(trifluoromethyl)-1,3-oxazole;1,2,4-oxadiazole;3-propan-2-yl-1,2,4-oxadiazole has a molecular weight of 1096.14 g/mol, XLogP of 12.48, 6 rotatable bonds, 0 hydrogen bond donors, and 24 hydrogen bond acceptors.

Where does this data come from?

All data for 2-cyclobutyl-5-methyl-1,3-oxazole;2-cyclopropyl-5-methyl-1,3-oxazole;3-ethyl-1,2,4-oxadiazole;3-methyl-1,2,4-oxadiazole;5-methyl-2-pyridin-2-yl-1,3-oxazole;5-methyl-2-pyridin-3-yl-1,3-oxazole;2-methyl-5-(trifluoromethyl)-1,3-oxazole;1,2,4-oxadiazole;3-propan-2-yl-1,2,4-oxadiazole is sourced from PubChem (CID 158500208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).