5-(4-chlorophenyl)-1-methyl-4-propan-2-ylimidazole;4-(4-chlorophenyl)-3-propan-2-yl-1,2-oxazole;1-[(2-methoxyphenyl)methyl]-2-propan-2-ylimidazole;1-(4-methoxyphenyl)-2-propan-2-ylimidazole;1-(3-methylbutyl)-2-propan-2-ylimidazole;2-(4-methylphenyl)-5-propan-2-yl-1,3-oxazole;5-(4-methylphenyl)-4-propan-2-yl-1,3-oxazole;2-methyl-4-phenyl-5-propan-2-yl-1,3-thiazole;5-(2-methylphenyl)-4-propan-2-yl-1,3-thiazole;bis(3-methyl-4-phenyl-5-propan-2-yl-1,2,4-triazole);1-phenyl-2-propan-2-ylimidazole;2-phenyl-5-propan-2-yl-1,3,4-oxadiazole;3-phenyl-5-propan-2-yl-1,2,4-oxadiazole;1-phenyl-5-propan-2-yltriazole

C184H222Cl2N28O7S2 — CID 157427189

About 5-(4-chlorophenyl)-1-methyl-4-propan-2-ylimidazole;4-(4-chlorophenyl)-3-propan-2-yl-1,2-oxazole;1-[(2-methoxyphenyl)methyl]-2-propan-2-ylimidazole;1-(4-methoxyphenyl)-2-propan-2-ylimidazole;1-(3-methylbutyl)-2-propan-2-ylimidazole;2-(4-methylphenyl)-5-propan-2-yl-1,3-oxazole;5-(4-methylphenyl)-4-propan-2-yl-1,3-oxazole;2-methyl-4-phenyl-5-propan-2-yl-1,3-thiazole;5-(2-methylphenyl)-4-propan-2-yl-1,3-thiazole;bis(3-methyl-4-phenyl-5-propan-2-yl-1,2,4-triazole);1-phenyl-2-propan-2-ylimidazole;2-phenyl-5-propan-2-yl-1,3,4-oxadiazole;3-phenyl-5-propan-2-yl-1,2,4-oxadiazole;1-phenyl-5-propan-2-yltriazole

5-(4-chlorophenyl)-1-methyl-4-propan-2-ylimidazole;4-(4-chlorophenyl)-3-propan-2-yl-1,2-oxazole;1-[(2-methoxyphenyl)methyl]-2-propan-2-ylimidazole;1-(4-methoxyphenyl)-2-propan-2-ylimidazole;1-(3-methylbutyl)-2-propan-2-ylimidazole;2-(4-methylphenyl)-5-propan-2-yl-1,3-oxazole;5-(4-methylphenyl)-4-propan-2-yl-1,3-oxazole;2-methyl-4-phenyl-5-propan-2-yl-1,3-thiazole;5-(2-methylphenyl)-4-propan-2-yl-1,3-thiazole;bis(3-methyl-4-phenyl-5-propan-2-yl-1,2,4-triazole);1-phenyl-2-propan-2-ylimidazole;2-phenyl-5-propan-2-yl-1,3,4-oxadiazole;3-phenyl-5-propan-2-yl-1,2,4-oxadiazole;1-phenyl-5-propan-2-yltriazole (PubChem CID 157427189) has the molecular formula C184H222Cl2N28O7S2 and a molecular weight of 3073.03 g/mol. Its IUPAC name is 5-(4-chlorophenyl)-1-methyl-4-propan-2-ylimidazole;4-(4-chlorophenyl)-3-propan-2-yl-1,2-oxazole;1-[(2-methoxyphenyl)methyl]-2-propan-2-ylimidazole;1-(4-methoxyphenyl)-2-propan-2-ylimidazole;1-(3-methylbutyl)-2-propan-2-ylimidazole;2-(4-methylphenyl)-5-propan-2-yl-1,3-oxazole;5-(4-methylphenyl)-4-propan-2-yl-1,3-oxazole;2-methyl-4-phenyl-5-propan-2-yl-1,3-thiazole;5-(2-methylphenyl)-4-propan-2-yl-1,3-thiazole;bis(3-methyl-4-phenyl-5-propan-2-yl-1,2,4-triazole);1-phenyl-2-propan-2-ylimidazole;2-phenyl-5-propan-2-yl-1,3,4-oxadiazole;3-phenyl-5-propan-2-yl-1,2,4-oxadiazole;1-phenyl-5-propan-2-yltriazole.

Molecular Properties

• Compound Name: 5-(4-chlorophenyl)-1-methyl-4-propan-2-ylimidazole;4-(4-chlorophenyl)-3-propan-2-yl-1,2-oxazole;1-[(2-methoxyphenyl)methyl]-2-propan-2-ylimidazole;1-(4-methoxyphenyl)-2-propan-2-ylimidazole;1-(3-methylbutyl)-2-propan-2-ylimidazole;2-(4-methylphenyl)-5-propan-2-yl-1,3-oxazole;5-(4-methylphenyl)-4-propan-2-yl-1,3-oxazole;2-methyl-4-phenyl-5-propan-2-yl-1,3-thiazole;5-(2-methylphenyl)-4-propan-2-yl-1,3-thiazole;bis(3-methyl-4-phenyl-5-propan-2-yl-1,2,4-triazole);1-phenyl-2-propan-2-ylimidazole;2-phenyl-5-propan-2-yl-1,3,4-oxadiazole;3-phenyl-5-propan-2-yl-1,2,4-oxadiazole;1-phenyl-5-propan-2-yltriazole
• PubChem CID: 157427189
• Molecular Formula: C184H222Cl2N28O7S2
• Molecular Weight: 3073.03 g/mol
• Exact Mass: 3069.67
• IUPAC Name: 5-(4-chlorophenyl)-1-methyl-4-propan-2-ylimidazole;4-(4-chlorophenyl)-3-propan-2-yl-1,2-oxazole;1-[(2-methoxyphenyl)methyl]-2-propan-2-ylimidazole;1-(4-methoxyphenyl)-2-propan-2-ylimidazole;1-(3-methylbutyl)-2-propan-2-ylimidazole;2-(4-methylphenyl)-5-propan-2-yl-1,3-oxazole;5-(4-methylphenyl)-4-propan-2-yl-1,3-oxazole;2-methyl-4-phenyl-5-propan-2-yl-1,3-thiazole;5-(2-methylphenyl)-4-propan-2-yl-1,3-thiazole;bis(3-methyl-4-phenyl-5-propan-2-yl-1,2,4-triazole);1-phenyl-2-propan-2-ylimidazole;2-phenyl-5-propan-2-yl-1,3,4-oxadiazole;3-phenyl-5-propan-2-yl-1,2,4-oxadiazole;1-phenyl-5-propan-2-yltriazole
• SMILES: CC(C)CCn1ccnc1C(C)C.CC(C)c1cnnn1-c1ccccc1.CC(C)c1nc(-c2ccccc2)no1.CC(C)c1nccn1-c1ccccc1.CC(C)c1ncn(C)c1-c1ccc(Cl)cc1.CC(C)c1nnc(-c2ccccc2)o1.CC(C)c1nocc1-c1ccc(Cl)cc1.COc1ccc(-n2ccnc2C(C)C)cc1.COc1ccccc1Cn1ccnc1C(C)C.Cc1ccc(-c2ncc(C(C)C)o2)cc1.Cc1ccc(-c2ocnc2C(C)C)cc1.Cc1ccccc1-c1scnc1C(C)C.Cc1nc(-c2ccccc2)c(C(C)C)s1.Cc1nnc(C(C)C)n1-c1ccccc1.Cc1nnc(C(C)C)n1-c1ccccc1
• InChI: InChI=1S/C14H18N2O.C13H15ClN2.C13H16N2O.2C13H15NO.2C13H15NS.C12H12ClNO.2C12H15N3.C12H14N2.C11H13N3.2C11H12N2O.C11H20N2/c1-11(2)14-15-8-9-16(14)10-12-6-4-5-7-13(12)17-3;1-9(2)12-13(16(3)8-15-12)10-4-6-11(14)7-5-10;1-10(2)13-14-8-9-15(13)11-4-6-12(16-3)7-5-11;1-9(2)12-13(15-8-14-12)11-6-4-10(3)5-7-11;1-9(2)12-8-14-13(15-12)11-6-4-10(3)5-7-11;1-9(2)12-13(15-8-14-12)11-7-5-4-6-10(11)3;1-9(2)13-12(14-10(3)15-13)11-7-5-4-6-8-11;1-8(2)12-11(7-15-14-12)9-3-5-10(13)6-4-9;2*1-9(2)12-14-13-10(3)15(12)11-7-5-4-6-8-11;1-10(2)12-13-8-9-14(12)11-6-4-3-5-7-11;1-9(2)11-8-12-13-14(11)10-6-4-3-5-7-10;1-8(2)11-12-10(13-14-11)9-6-4-3-5-7-9;1-8(2)10-12-13-11(14-10)9-6-4-3-5-7-9;1-9(2)5-7-13-8-6-12-11(13)10(3)4/h4-9,11H,10H2,1-3H3;4-9H,1-3H3;4-10H,1-3H3;4*4-9H,1-3H3;3-8H,1-2H3;2*4-9H,1-3H3;3-10H,1-2H3;3-9H,1-2H3;2*3-8H,1-2H3;6,8-10H,5,7H2,1-4H3
• InChIKey: BQCDFQNDJHGAHZ-UHFFFAOYSA-N
• XLogP: 49.64
• TPSA: 381.40 Ų
• H-Bond Acceptors: 37
• Rotatable Bonds: 35
• Heavy Atoms: 223
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3073.03
LogP ≤ 5	49.64
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	37

Frequently Asked Questions

What is the IUPAC name of 5-(4-chlorophenyl)-1-methyl-4-propan-2-ylimidazole;4-(4-chlorophenyl)-3-propan-2-yl-1,2-oxazole;1-[(2-methoxyphenyl)methyl]-2-propan-2-ylimidazole;1-(4-methoxyphenyl)-2-propan-2-ylimidazole;1-(3-methylbutyl)-2-propan-2-ylimidazole;2-(4-methylphenyl)-5-propan-2-yl-1,3-oxazole;5-(4-methylphenyl)-4-propan-2-yl-1,3-oxazole;2-methyl-4-phenyl-5-propan-2-yl-1,3-thiazole;5-(2-methylphenyl)-4-propan-2-yl-1,3-thiazole;bis(3-methyl-4-phenyl-5-propan-2-yl-1,2,4-triazole);1-phenyl-2-propan-2-ylimidazole;2-phenyl-5-propan-2-yl-1,3,4-oxadiazole;3-phenyl-5-propan-2-yl-1,2,4-oxadiazole;1-phenyl-5-propan-2-yltriazole?

The IUPAC name of 5-(4-chlorophenyl)-1-methyl-4-propan-2-ylimidazole;4-(4-chlorophenyl)-3-propan-2-yl-1,2-oxazole;1-[(2-methoxyphenyl)methyl]-2-propan-2-ylimidazole;1-(4-methoxyphenyl)-2-propan-2-ylimidazole;1-(3-methylbutyl)-2-propan-2-ylimidazole;2-(4-methylphenyl)-5-propan-2-yl-1,3-oxazole;5-(4-methylphenyl)-4-propan-2-yl-1,3-oxazole;2-methyl-4-phenyl-5-propan-2-yl-1,3-thiazole;5-(2-methylphenyl)-4-propan-2-yl-1,3-thiazole;bis(3-methyl-4-phenyl-5-propan-2-yl-1,2,4-triazole);1-phenyl-2-propan-2-ylimidazole;2-phenyl-5-propan-2-yl-1,3,4-oxadiazole;3-phenyl-5-propan-2-yl-1,2,4-oxadiazole;1-phenyl-5-propan-2-yltriazole (CID 157427189) is 5-(4-chlorophenyl)-1-methyl-4-propan-2-ylimidazole;4-(4-chlorophenyl)-3-propan-2-yl-1,2-oxazole;1-[(2-methoxyphenyl)methyl]-2-propan-2-ylimidazole;1-(4-methoxyphenyl)-2-propan-2-ylimidazole;1-(3-methylbutyl)-2-propan-2-ylimidazole;2-(4-methylphenyl)-5-propan-2-yl-1,3-oxazole;5-(4-methylphenyl)-4-propan-2-yl-1,3-oxazole;2-methyl-4-phenyl-5-propan-2-yl-1,3-thiazole;5-(2-methylphenyl)-4-propan-2-yl-1,3-thiazole;bis(3-methyl-4-phenyl-5-propan-2-yl-1,2,4-triazole);1-phenyl-2-propan-2-ylimidazole;2-phenyl-5-propan-2-yl-1,3,4-oxadiazole;3-phenyl-5-propan-2-yl-1,2,4-oxadiazole;1-phenyl-5-propan-2-yltriazole.

What is the SMILES notation for 5-(4-chlorophenyl)-1-methyl-4-propan-2-ylimidazole;4-(4-chlorophenyl)-3-propan-2-yl-1,2-oxazole;1-[(2-methoxyphenyl)methyl]-2-propan-2-ylimidazole;1-(4-methoxyphenyl)-2-propan-2-ylimidazole;1-(3-methylbutyl)-2-propan-2-ylimidazole;2-(4-methylphenyl)-5-propan-2-yl-1,3-oxazole;5-(4-methylphenyl)-4-propan-2-yl-1,3-oxazole;2-methyl-4-phenyl-5-propan-2-yl-1,3-thiazole;5-(2-methylphenyl)-4-propan-2-yl-1,3-thiazole;bis(3-methyl-4-phenyl-5-propan-2-yl-1,2,4-triazole);1-phenyl-2-propan-2-ylimidazole;2-phenyl-5-propan-2-yl-1,3,4-oxadiazole;3-phenyl-5-propan-2-yl-1,2,4-oxadiazole;1-phenyl-5-propan-2-yltriazole?

The canonical SMILES for 5-(4-chlorophenyl)-1-methyl-4-propan-2-ylimidazole;4-(4-chlorophenyl)-3-propan-2-yl-1,2-oxazole;1-[(2-methoxyphenyl)methyl]-2-propan-2-ylimidazole;1-(4-methoxyphenyl)-2-propan-2-ylimidazole;1-(3-methylbutyl)-2-propan-2-ylimidazole;2-(4-methylphenyl)-5-propan-2-yl-1,3-oxazole;5-(4-methylphenyl)-4-propan-2-yl-1,3-oxazole;2-methyl-4-phenyl-5-propan-2-yl-1,3-thiazole;5-(2-methylphenyl)-4-propan-2-yl-1,3-thiazole;bis(3-methyl-4-phenyl-5-propan-2-yl-1,2,4-triazole);1-phenyl-2-propan-2-ylimidazole;2-phenyl-5-propan-2-yl-1,3,4-oxadiazole;3-phenyl-5-propan-2-yl-1,2,4-oxadiazole;1-phenyl-5-propan-2-yltriazole is CC(C)CCn1ccnc1C(C)C.CC(C)c1cnnn1-c1ccccc1.CC(C)c1nc(-c2ccccc2)no1.CC(C)c1nccn1-c1ccccc1.CC(C)c1ncn(C)c1-c1ccc(Cl)cc1.CC(C)c1nnc(-c2ccccc2)o1.CC(C)c1nocc1-c1ccc(Cl)cc1.COc1ccc(-n2ccnc2C(C)C)cc1.COc1ccccc1Cn1ccnc1C(C)C.Cc1ccc(-c2ncc(C(C)C)o2)cc1.Cc1ccc(-c2ocnc2C(C)C)cc1.Cc1ccccc1-c1scnc1C(C)C.Cc1nc(-c2ccccc2)c(C(C)C)s1.Cc1nnc(C(C)C)n1-c1ccccc1.Cc1nnc(C(C)C)n1-c1ccccc1.

What is the InChIKey of 5-(4-chlorophenyl)-1-methyl-4-propan-2-ylimidazole;4-(4-chlorophenyl)-3-propan-2-yl-1,2-oxazole;1-[(2-methoxyphenyl)methyl]-2-propan-2-ylimidazole;1-(4-methoxyphenyl)-2-propan-2-ylimidazole;1-(3-methylbutyl)-2-propan-2-ylimidazole;2-(4-methylphenyl)-5-propan-2-yl-1,3-oxazole;5-(4-methylphenyl)-4-propan-2-yl-1,3-oxazole;2-methyl-4-phenyl-5-propan-2-yl-1,3-thiazole;5-(2-methylphenyl)-4-propan-2-yl-1,3-thiazole;bis(3-methyl-4-phenyl-5-propan-2-yl-1,2,4-triazole);1-phenyl-2-propan-2-ylimidazole;2-phenyl-5-propan-2-yl-1,3,4-oxadiazole;3-phenyl-5-propan-2-yl-1,2,4-oxadiazole;1-phenyl-5-propan-2-yltriazole?

The InChIKey is BQCDFQNDJHGAHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O.C13H15ClN2.C13H16N2O.2C13H15NO.2C13H15NS.C12H12ClNO.2C12H15N3.C12H14N2.C11H13N3.2C11H12N2O.C11H20N2/c1-11(2)14-15-8-9-16(14)10-12-6-4-5-7-13(12)17-3;1-9(2)12-13(16(3)8-15-12)10-4-6-11(14)7-5-10;1-10(2)13-14-8-9-15(13)11-4-6-12(16-3)7-5-11;1-9(2)12-13(15-8-14-12)11-6-4-10(3)5-7-11;1-9(2)12-8-14-13(15-12)11-6-4-10(3)5-7-11;1-9(2)12-13(15-8-14-12)11-7-5-4-6-10(11)3;1-9(2)13-12(14-10(3)15-13)11-7-5-4-6-8-11;1-8(2)12-11(7-15-14-12)9-3-5-10(13)6-4-9;2*1-9(2)12-14-13-10(3)15(12)11-7-5-4-6-8-11;1-10(2)12-13-8-9-14(12)11-6-4-3-5-7-11;1-9(2)11-8-12-13-14(11)10-6-4-3-5-7-10;1-8(2)11-12-10(13-14-11)9-6-4-3-5-7-9;1-8(2)10-12-13-11(14-10)9-6-4-3-5-7-9;1-9(2)5-7-13-8-6-12-11(13)10(3)4/h4-9,11H,10H2,1-3H3;4-9H,1-3H3;4-10H,1-3H3;4*4-9H,1-3H3;3-8H,1-2H3;2*4-9H,1-3H3;3-10H,1-2H3;3-9H,1-2H3;2*3-8H,1-2H3;6,8-10H,5,7H2,1-4H3.

What are the key properties of 5-(4-chlorophenyl)-1-methyl-4-propan-2-ylimidazole;4-(4-chlorophenyl)-3-propan-2-yl-1,2-oxazole;1-[(2-methoxyphenyl)methyl]-2-propan-2-ylimidazole;1-(4-methoxyphenyl)-2-propan-2-ylimidazole;1-(3-methylbutyl)-2-propan-2-ylimidazole;2-(4-methylphenyl)-5-propan-2-yl-1,3-oxazole;5-(4-methylphenyl)-4-propan-2-yl-1,3-oxazole;2-methyl-4-phenyl-5-propan-2-yl-1,3-thiazole;5-(2-methylphenyl)-4-propan-2-yl-1,3-thiazole;bis(3-methyl-4-phenyl-5-propan-2-yl-1,2,4-triazole);1-phenyl-2-propan-2-ylimidazole;2-phenyl-5-propan-2-yl-1,3,4-oxadiazole;3-phenyl-5-propan-2-yl-1,2,4-oxadiazole;1-phenyl-5-propan-2-yltriazole?

5-(4-chlorophenyl)-1-methyl-4-propan-2-ylimidazole;4-(4-chlorophenyl)-3-propan-2-yl-1,2-oxazole;1-[(2-methoxyphenyl)methyl]-2-propan-2-ylimidazole;1-(4-methoxyphenyl)-2-propan-2-ylimidazole;1-(3-methylbutyl)-2-propan-2-ylimidazole;2-(4-methylphenyl)-5-propan-2-yl-1,3-oxazole;5-(4-methylphenyl)-4-propan-2-yl-1,3-oxazole;2-methyl-4-phenyl-5-propan-2-yl-1,3-thiazole;5-(2-methylphenyl)-4-propan-2-yl-1,3-thiazole;bis(3-methyl-4-phenyl-5-propan-2-yl-1,2,4-triazole);1-phenyl-2-propan-2-ylimidazole;2-phenyl-5-propan-2-yl-1,3,4-oxadiazole;3-phenyl-5-propan-2-yl-1,2,4-oxadiazole;1-phenyl-5-propan-2-yltriazole has a molecular weight of 3073.03 g/mol, XLogP of 49.64, 35 rotatable bonds, 0 hydrogen bond donors, and 37 hydrogen bond acceptors.

Where does this data come from?

All data for 5-(4-chlorophenyl)-1-methyl-4-propan-2-ylimidazole;4-(4-chlorophenyl)-3-propan-2-yl-1,2-oxazole;1-[(2-methoxyphenyl)methyl]-2-propan-2-ylimidazole;1-(4-methoxyphenyl)-2-propan-2-ylimidazole;1-(3-methylbutyl)-2-propan-2-ylimidazole;2-(4-methylphenyl)-5-propan-2-yl-1,3-oxazole;5-(4-methylphenyl)-4-propan-2-yl-1,3-oxazole;2-methyl-4-phenyl-5-propan-2-yl-1,3-thiazole;5-(2-methylphenyl)-4-propan-2-yl-1,3-thiazole;bis(3-methyl-4-phenyl-5-propan-2-yl-1,2,4-triazole);1-phenyl-2-propan-2-ylimidazole;2-phenyl-5-propan-2-yl-1,3,4-oxadiazole;3-phenyl-5-propan-2-yl-1,2,4-oxadiazole;1-phenyl-5-propan-2-yltriazole is sourced from PubChem (CID 157427189), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).