5-cyclopenta-1,4-dien-1-yl-2-methyl-1,3-oxazole;4-(furan-2-yl)-2-methyl-1,3-oxazole;5-(furan-3-yl)-2-methyl-1,3-oxazole;methane;2-methyl-4-(1-methylimidazol-2-yl)-1,3-oxazole;2-methyl-4-(1-methylpyrrol-2-yl)-1,3-oxazole;2-methyl-4-(1,3-oxazol-2-yl)-1,3-oxazole;2-methyl-4-(1,3-oxazol-5-yl)-1,3-oxazole;tris(2-methyl-4-phenyl-1,3-oxazole);2-methyl-4-pyrazin-2-yl-1,3-oxazole;tris(2-methyl-4-pyridin-2-yl-1,3-oxazole);2-methyl-4-pyrimidin-2-yl-1,3-oxazole;2-methyl-5-(3H-pyrrol-5-yl)-1,3-oxazole;2-methyl-4-(1,3-thiazol-2-yl)-1,3-oxazole;2-methyl-4-thiophen-2-yl-1,3-oxazole

C163H184N32O22S2 — CID 159266416

About 5-cyclopenta-1,4-dien-1-yl-2-methyl-1,3-oxazole;4-(furan-2-yl)-2-methyl-1,3-oxazole;5-(furan-3-yl)-2-methyl-1,3-oxazole;methane;2-methyl-4-(1-methylimidazol-2-yl)-1,3-oxazole;2-methyl-4-(1-methylpyrrol-2-yl)-1,3-oxazole;2-methyl-4-(1,3-oxazol-2-yl)-1,3-oxazole;2-methyl-4-(1,3-oxazol-5-yl)-1,3-oxazole;tris(2-methyl-4-phenyl-1,3-oxazole);2-methyl-4-pyrazin-2-yl-1,3-oxazole;tris(2-methyl-4-pyridin-2-yl-1,3-oxazole);2-methyl-4-pyrimidin-2-yl-1,3-oxazole;2-methyl-5-(3H-pyrrol-5-yl)-1,3-oxazole;2-methyl-4-(1,3-thiazol-2-yl)-1,3-oxazole;2-methyl-4-thiophen-2-yl-1,3-oxazole

5-cyclopenta-1,4-dien-1-yl-2-methyl-1,3-oxazole;4-(furan-2-yl)-2-methyl-1,3-oxazole;5-(furan-3-yl)-2-methyl-1,3-oxazole;methane;2-methyl-4-(1-methylimidazol-2-yl)-1,3-oxazole;2-methyl-4-(1-methylpyrrol-2-yl)-1,3-oxazole;2-methyl-4-(1,3-oxazol-2-yl)-1,3-oxazole;2-methyl-4-(1,3-oxazol-5-yl)-1,3-oxazole;tris(2-methyl-4-phenyl-1,3-oxazole);2-methyl-4-pyrazin-2-yl-1,3-oxazole;tris(2-methyl-4-pyridin-2-yl-1,3-oxazole);2-methyl-4-pyrimidin-2-yl-1,3-oxazole;2-methyl-5-(3H-pyrrol-5-yl)-1,3-oxazole;2-methyl-4-(1,3-thiazol-2-yl)-1,3-oxazole;2-methyl-4-thiophen-2-yl-1,3-oxazole (PubChem CID 159266416) has the molecular formula C163H184N32O22S2 and a molecular weight of 3007.60 g/mol. Its IUPAC name is 5-cyclopenta-1,4-dien-1-yl-2-methyl-1,3-oxazole;4-(furan-2-yl)-2-methyl-1,3-oxazole;5-(furan-3-yl)-2-methyl-1,3-oxazole;methane;2-methyl-4-(1-methylimidazol-2-yl)-1,3-oxazole;2-methyl-4-(1-methylpyrrol-2-yl)-1,3-oxazole;2-methyl-4-(1,3-oxazol-2-yl)-1,3-oxazole;2-methyl-4-(1,3-oxazol-5-yl)-1,3-oxazole;tris(2-methyl-4-phenyl-1,3-oxazole);2-methyl-4-pyrazin-2-yl-1,3-oxazole;tris(2-methyl-4-pyridin-2-yl-1,3-oxazole);2-methyl-4-pyrimidin-2-yl-1,3-oxazole;2-methyl-5-(3H-pyrrol-5-yl)-1,3-oxazole;2-methyl-4-(1,3-thiazol-2-yl)-1,3-oxazole;2-methyl-4-thiophen-2-yl-1,3-oxazole.

Molecular Properties

• Compound Name: 5-cyclopenta-1,4-dien-1-yl-2-methyl-1,3-oxazole;4-(furan-2-yl)-2-methyl-1,3-oxazole;5-(furan-3-yl)-2-methyl-1,3-oxazole;methane;2-methyl-4-(1-methylimidazol-2-yl)-1,3-oxazole;2-methyl-4-(1-methylpyrrol-2-yl)-1,3-oxazole;2-methyl-4-(1,3-oxazol-2-yl)-1,3-oxazole;2-methyl-4-(1,3-oxazol-5-yl)-1,3-oxazole;tris(2-methyl-4-phenyl-1,3-oxazole);2-methyl-4-pyrazin-2-yl-1,3-oxazole;tris(2-methyl-4-pyridin-2-yl-1,3-oxazole);2-methyl-4-pyrimidin-2-yl-1,3-oxazole;2-methyl-5-(3H-pyrrol-5-yl)-1,3-oxazole;2-methyl-4-(1,3-thiazol-2-yl)-1,3-oxazole;2-methyl-4-thiophen-2-yl-1,3-oxazole
• PubChem CID: 159266416
• Molecular Formula: C163H184N32O22S2
• Molecular Weight: 3007.60 g/mol
• Exact Mass: 3005.37
• IUPAC Name: 5-cyclopenta-1,4-dien-1-yl-2-methyl-1,3-oxazole;4-(furan-2-yl)-2-methyl-1,3-oxazole;5-(furan-3-yl)-2-methyl-1,3-oxazole;methane;2-methyl-4-(1-methylimidazol-2-yl)-1,3-oxazole;2-methyl-4-(1-methylpyrrol-2-yl)-1,3-oxazole;2-methyl-4-(1,3-oxazol-2-yl)-1,3-oxazole;2-methyl-4-(1,3-oxazol-5-yl)-1,3-oxazole;tris(2-methyl-4-phenyl-1,3-oxazole);2-methyl-4-pyrazin-2-yl-1,3-oxazole;tris(2-methyl-4-pyridin-2-yl-1,3-oxazole);2-methyl-4-pyrimidin-2-yl-1,3-oxazole;2-methyl-5-(3H-pyrrol-5-yl)-1,3-oxazole;2-methyl-4-(1,3-thiazol-2-yl)-1,3-oxazole;2-methyl-4-thiophen-2-yl-1,3-oxazole
• SMILES: C.C.C.C.C.C.C.C.C.C.C.Cc1nc(-c2ccccc2)co1.Cc1nc(-c2ccccc2)co1.Cc1nc(-c2ccccc2)co1.Cc1nc(-c2ccccn2)co1.Cc1nc(-c2ccccn2)co1.Cc1nc(-c2ccccn2)co1.Cc1nc(-c2cccn2C)co1.Cc1nc(-c2ccco2)co1.Cc1nc(-c2cccs2)co1.Cc1nc(-c2cnccn2)co1.Cc1nc(-c2cnco2)co1.Cc1nc(-c2ncccn2)co1.Cc1nc(-c2nccn2C)co1.Cc1nc(-c2ncco2)co1.Cc1nc(-c2nccs2)co1.Cc1ncc(-c2ccoc2)o1.Cc1ncc(C2=CCC=C2)o1.Cc1ncc(C2=CCC=N2)o1
• InChI: InChI=1S/3C10H9NO.C9H10N2O.3C9H8N2O.C9H9NO.C8H9N3O.2C8H7N3O.C8H8N2O.2C8H7NO2.C8H7NOS.2C7H6N2O2.C7H6N2OS.11CH4/c3*1-8-11-10(7-12-8)9-5-3-2-4-6-9;1-7-10-8(6-12-7)9-4-3-5-11(9)2;3*1-7-11-9(6-12-7)8-4-2-3-5-10-8;1-7-10-6-9(11-7)8-4-2-3-5-8;1-6-10-7(5-12-6)8-9-3-4-11(8)2;1-6-11-8(5-12-6)7-4-9-2-3-10-7;1-6-11-7(5-12-6)8-9-3-2-4-10-8;1-6-10-5-8(11-6)7-3-2-4-9-7;1-6-9-4-8(11-6)7-2-3-10-5-7;1-6-9-7(5-11-6)8-3-2-4-10-8;1-6-9-7(5-10-6)8-3-2-4-11-8;1-5-9-6(3-10-5)7-2-8-4-11-7;1-5-9-6(4-11-5)7-8-2-3-10-7;1-5-9-6(4-10-5)7-8-2-3-11-7;;;;;;;;;;;/h3*2-7H,1H3;3-6H,1-2H3;3*2-6H,1H3;2,4-6H,3H2,1H3;3-5H,1-2H3;2*2-5H,1H3;3-5H,2H2,1H3;3*2-5H,1H3;3*2-4H,1H3;11*1H4
• InChIKey: KXDUEERHMZXEQA-UHFFFAOYSA-N
• XLogP: 44.04
• TPSA: 685.11 Ų
• H-Bond Acceptors: 56
• Rotatable Bonds: 18
• Heavy Atoms: 219
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3007.60
LogP ≤ 5	44.04
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	56

Frequently Asked Questions

What is the IUPAC name of 5-cyclopenta-1,4-dien-1-yl-2-methyl-1,3-oxazole;4-(furan-2-yl)-2-methyl-1,3-oxazole;5-(furan-3-yl)-2-methyl-1,3-oxazole;methane;2-methyl-4-(1-methylimidazol-2-yl)-1,3-oxazole;2-methyl-4-(1-methylpyrrol-2-yl)-1,3-oxazole;2-methyl-4-(1,3-oxazol-2-yl)-1,3-oxazole;2-methyl-4-(1,3-oxazol-5-yl)-1,3-oxazole;tris(2-methyl-4-phenyl-1,3-oxazole);2-methyl-4-pyrazin-2-yl-1,3-oxazole;tris(2-methyl-4-pyridin-2-yl-1,3-oxazole);2-methyl-4-pyrimidin-2-yl-1,3-oxazole;2-methyl-5-(3H-pyrrol-5-yl)-1,3-oxazole;2-methyl-4-(1,3-thiazol-2-yl)-1,3-oxazole;2-methyl-4-thiophen-2-yl-1,3-oxazole?

The IUPAC name of 5-cyclopenta-1,4-dien-1-yl-2-methyl-1,3-oxazole;4-(furan-2-yl)-2-methyl-1,3-oxazole;5-(furan-3-yl)-2-methyl-1,3-oxazole;methane;2-methyl-4-(1-methylimidazol-2-yl)-1,3-oxazole;2-methyl-4-(1-methylpyrrol-2-yl)-1,3-oxazole;2-methyl-4-(1,3-oxazol-2-yl)-1,3-oxazole;2-methyl-4-(1,3-oxazol-5-yl)-1,3-oxazole;tris(2-methyl-4-phenyl-1,3-oxazole);2-methyl-4-pyrazin-2-yl-1,3-oxazole;tris(2-methyl-4-pyridin-2-yl-1,3-oxazole);2-methyl-4-pyrimidin-2-yl-1,3-oxazole;2-methyl-5-(3H-pyrrol-5-yl)-1,3-oxazole;2-methyl-4-(1,3-thiazol-2-yl)-1,3-oxazole;2-methyl-4-thiophen-2-yl-1,3-oxazole (CID 159266416) is 5-cyclopenta-1,4-dien-1-yl-2-methyl-1,3-oxazole;4-(furan-2-yl)-2-methyl-1,3-oxazole;5-(furan-3-yl)-2-methyl-1,3-oxazole;methane;2-methyl-4-(1-methylimidazol-2-yl)-1,3-oxazole;2-methyl-4-(1-methylpyrrol-2-yl)-1,3-oxazole;2-methyl-4-(1,3-oxazol-2-yl)-1,3-oxazole;2-methyl-4-(1,3-oxazol-5-yl)-1,3-oxazole;tris(2-methyl-4-phenyl-1,3-oxazole);2-methyl-4-pyrazin-2-yl-1,3-oxazole;tris(2-methyl-4-pyridin-2-yl-1,3-oxazole);2-methyl-4-pyrimidin-2-yl-1,3-oxazole;2-methyl-5-(3H-pyrrol-5-yl)-1,3-oxazole;2-methyl-4-(1,3-thiazol-2-yl)-1,3-oxazole;2-methyl-4-thiophen-2-yl-1,3-oxazole.

What is the SMILES notation for 5-cyclopenta-1,4-dien-1-yl-2-methyl-1,3-oxazole;4-(furan-2-yl)-2-methyl-1,3-oxazole;5-(furan-3-yl)-2-methyl-1,3-oxazole;methane;2-methyl-4-(1-methylimidazol-2-yl)-1,3-oxazole;2-methyl-4-(1-methylpyrrol-2-yl)-1,3-oxazole;2-methyl-4-(1,3-oxazol-2-yl)-1,3-oxazole;2-methyl-4-(1,3-oxazol-5-yl)-1,3-oxazole;tris(2-methyl-4-phenyl-1,3-oxazole);2-methyl-4-pyrazin-2-yl-1,3-oxazole;tris(2-methyl-4-pyridin-2-yl-1,3-oxazole);2-methyl-4-pyrimidin-2-yl-1,3-oxazole;2-methyl-5-(3H-pyrrol-5-yl)-1,3-oxazole;2-methyl-4-(1,3-thiazol-2-yl)-1,3-oxazole;2-methyl-4-thiophen-2-yl-1,3-oxazole?

The canonical SMILES for 5-cyclopenta-1,4-dien-1-yl-2-methyl-1,3-oxazole;4-(furan-2-yl)-2-methyl-1,3-oxazole;5-(furan-3-yl)-2-methyl-1,3-oxazole;methane;2-methyl-4-(1-methylimidazol-2-yl)-1,3-oxazole;2-methyl-4-(1-methylpyrrol-2-yl)-1,3-oxazole;2-methyl-4-(1,3-oxazol-2-yl)-1,3-oxazole;2-methyl-4-(1,3-oxazol-5-yl)-1,3-oxazole;tris(2-methyl-4-phenyl-1,3-oxazole);2-methyl-4-pyrazin-2-yl-1,3-oxazole;tris(2-methyl-4-pyridin-2-yl-1,3-oxazole);2-methyl-4-pyrimidin-2-yl-1,3-oxazole;2-methyl-5-(3H-pyrrol-5-yl)-1,3-oxazole;2-methyl-4-(1,3-thiazol-2-yl)-1,3-oxazole;2-methyl-4-thiophen-2-yl-1,3-oxazole is C.C.C.C.C.C.C.C.C.C.C.Cc1nc(-c2ccccc2)co1.Cc1nc(-c2ccccc2)co1.Cc1nc(-c2ccccc2)co1.Cc1nc(-c2ccccn2)co1.Cc1nc(-c2ccccn2)co1.Cc1nc(-c2ccccn2)co1.Cc1nc(-c2cccn2C)co1.Cc1nc(-c2ccco2)co1.Cc1nc(-c2cccs2)co1.Cc1nc(-c2cnccn2)co1.Cc1nc(-c2cnco2)co1.Cc1nc(-c2ncccn2)co1.Cc1nc(-c2nccn2C)co1.Cc1nc(-c2ncco2)co1.Cc1nc(-c2nccs2)co1.Cc1ncc(-c2ccoc2)o1.Cc1ncc(C2=CCC=C2)o1.Cc1ncc(C2=CCC=N2)o1.

What is the InChIKey of 5-cyclopenta-1,4-dien-1-yl-2-methyl-1,3-oxazole;4-(furan-2-yl)-2-methyl-1,3-oxazole;5-(furan-3-yl)-2-methyl-1,3-oxazole;methane;2-methyl-4-(1-methylimidazol-2-yl)-1,3-oxazole;2-methyl-4-(1-methylpyrrol-2-yl)-1,3-oxazole;2-methyl-4-(1,3-oxazol-2-yl)-1,3-oxazole;2-methyl-4-(1,3-oxazol-5-yl)-1,3-oxazole;tris(2-methyl-4-phenyl-1,3-oxazole);2-methyl-4-pyrazin-2-yl-1,3-oxazole;tris(2-methyl-4-pyridin-2-yl-1,3-oxazole);2-methyl-4-pyrimidin-2-yl-1,3-oxazole;2-methyl-5-(3H-pyrrol-5-yl)-1,3-oxazole;2-methyl-4-(1,3-thiazol-2-yl)-1,3-oxazole;2-methyl-4-thiophen-2-yl-1,3-oxazole?

The InChIKey is KXDUEERHMZXEQA-UHFFFAOYSA-N. The full InChI is InChI=1S/3C10H9NO.C9H10N2O.3C9H8N2O.C9H9NO.C8H9N3O.2C8H7N3O.C8H8N2O.2C8H7NO2.C8H7NOS.2C7H6N2O2.C7H6N2OS.11CH4/c3*1-8-11-10(7-12-8)9-5-3-2-4-6-9;1-7-10-8(6-12-7)9-4-3-5-11(9)2;3*1-7-11-9(6-12-7)8-4-2-3-5-10-8;1-7-10-6-9(11-7)8-4-2-3-5-8;1-6-10-7(5-12-6)8-9-3-4-11(8)2;1-6-11-8(5-12-6)7-4-9-2-3-10-7;1-6-11-7(5-12-6)8-9-3-2-4-10-8;1-6-10-5-8(11-6)7-3-2-4-9-7;1-6-9-4-8(11-6)7-2-3-10-5-7;1-6-9-7(5-11-6)8-3-2-4-10-8;1-6-9-7(5-10-6)8-3-2-4-11-8;1-5-9-6(3-10-5)7-2-8-4-11-7;1-5-9-6(4-11-5)7-8-2-3-10-7;1-5-9-6(4-10-5)7-8-2-3-11-7;;;;;;;;;;;/h3*2-7H,1H3;3-6H,1-2H3;3*2-6H,1H3;2,4-6H,3H2,1H3;3-5H,1-2H3;2*2-5H,1H3;3-5H,2H2,1H3;3*2-5H,1H3;3*2-4H,1H3;11*1H4.

What are the key properties of 5-cyclopenta-1,4-dien-1-yl-2-methyl-1,3-oxazole;4-(furan-2-yl)-2-methyl-1,3-oxazole;5-(furan-3-yl)-2-methyl-1,3-oxazole;methane;2-methyl-4-(1-methylimidazol-2-yl)-1,3-oxazole;2-methyl-4-(1-methylpyrrol-2-yl)-1,3-oxazole;2-methyl-4-(1,3-oxazol-2-yl)-1,3-oxazole;2-methyl-4-(1,3-oxazol-5-yl)-1,3-oxazole;tris(2-methyl-4-phenyl-1,3-oxazole);2-methyl-4-pyrazin-2-yl-1,3-oxazole;tris(2-methyl-4-pyridin-2-yl-1,3-oxazole);2-methyl-4-pyrimidin-2-yl-1,3-oxazole;2-methyl-5-(3H-pyrrol-5-yl)-1,3-oxazole;2-methyl-4-(1,3-thiazol-2-yl)-1,3-oxazole;2-methyl-4-thiophen-2-yl-1,3-oxazole?

5-cyclopenta-1,4-dien-1-yl-2-methyl-1,3-oxazole;4-(furan-2-yl)-2-methyl-1,3-oxazole;5-(furan-3-yl)-2-methyl-1,3-oxazole;methane;2-methyl-4-(1-methylimidazol-2-yl)-1,3-oxazole;2-methyl-4-(1-methylpyrrol-2-yl)-1,3-oxazole;2-methyl-4-(1,3-oxazol-2-yl)-1,3-oxazole;2-methyl-4-(1,3-oxazol-5-yl)-1,3-oxazole;tris(2-methyl-4-phenyl-1,3-oxazole);2-methyl-4-pyrazin-2-yl-1,3-oxazole;tris(2-methyl-4-pyridin-2-yl-1,3-oxazole);2-methyl-4-pyrimidin-2-yl-1,3-oxazole;2-methyl-5-(3H-pyrrol-5-yl)-1,3-oxazole;2-methyl-4-(1,3-thiazol-2-yl)-1,3-oxazole;2-methyl-4-thiophen-2-yl-1,3-oxazole has a molecular weight of 3007.60 g/mol, XLogP of 44.04, 18 rotatable bonds, 0 hydrogen bond donors, and 56 hydrogen bond acceptors.

Where does this data come from?

All data for 5-cyclopenta-1,4-dien-1-yl-2-methyl-1,3-oxazole;4-(furan-2-yl)-2-methyl-1,3-oxazole;5-(furan-3-yl)-2-methyl-1,3-oxazole;methane;2-methyl-4-(1-methylimidazol-2-yl)-1,3-oxazole;2-methyl-4-(1-methylpyrrol-2-yl)-1,3-oxazole;2-methyl-4-(1,3-oxazol-2-yl)-1,3-oxazole;2-methyl-4-(1,3-oxazol-5-yl)-1,3-oxazole;tris(2-methyl-4-phenyl-1,3-oxazole);2-methyl-4-pyrazin-2-yl-1,3-oxazole;tris(2-methyl-4-pyridin-2-yl-1,3-oxazole);2-methyl-4-pyrimidin-2-yl-1,3-oxazole;2-methyl-5-(3H-pyrrol-5-yl)-1,3-oxazole;2-methyl-4-(1,3-thiazol-2-yl)-1,3-oxazole;2-methyl-4-thiophen-2-yl-1,3-oxazole is sourced from PubChem (CID 159266416), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).