N-benzyl-2-tert-butyl-1,3-oxazol-5-amine;2-tert-butyl-5-chloro-4-methyl-3-phenyl-3H-pyrazol-2-ium;5-tert-butyl-2-(3-diethylphosphorylphenyl)-1,3-oxazole;4-tert-butyl-2-imidazol-1-yl-1,3-oxazole;5-tert-butyl-3-methyl-1,2,4-oxadiazole;(2-tert-butyl-1,3-oxazol-4-yl)methanamine;[3-(4-tert-butyl-1,3-oxazol-2-yl)phenyl]-piperazin-1-ylmethanone;(5-tert-butyl-1,2-oxazol-4-yl)-piperazin-1-ylmethanone;(5-tert-butyl-1,3-oxazol-2-yl)-pyrrolidin-1-ylmethanone;2-tert-butyl-5-phenyl-1,3,4-oxadiazole;5-tert-butyl-3-phenyl-1,2-oxazole;4-tert-butyl-3-(piperazin-1-ylmethyl)-1,2-oxazol-5-amine;5-tert-butyl-3-[3-(trifluoromethyl)phenyl]-1,2,4-oxadiazole

C162H223ClF3N29O16P+ — CID 160623089

About N-benzyl-2-tert-butyl-1,3-oxazol-5-amine;2-tert-butyl-5-chloro-4-methyl-3-phenyl-3H-pyrazol-2-ium;5-tert-butyl-2-(3-diethylphosphorylphenyl)-1,3-oxazole;4-tert-butyl-2-imidazol-1-yl-1,3-oxazole;5-tert-butyl-3-methyl-1,2,4-oxadiazole;(2-tert-butyl-1,3-oxazol-4-yl)methanamine;[3-(4-tert-butyl-1,3-oxazol-2-yl)phenyl]-piperazin-1-ylmethanone;(5-tert-butyl-1,2-oxazol-4-yl)-piperazin-1-ylmethanone;(5-tert-butyl-1,3-oxazol-2-yl)-pyrrolidin-1-ylmethanone;2-tert-butyl-5-phenyl-1,3,4-oxadiazole;5-tert-butyl-3-phenyl-1,2-oxazole;4-tert-butyl-3-(piperazin-1-ylmethyl)-1,2-oxazol-5-amine;5-tert-butyl-3-[3-(trifluoromethyl)phenyl]-1,2,4-oxadiazole

N-benzyl-2-tert-butyl-1,3-oxazol-5-amine;2-tert-butyl-5-chloro-4-methyl-3-phenyl-3H-pyrazol-2-ium;5-tert-butyl-2-(3-diethylphosphorylphenyl)-1,3-oxazole;4-tert-butyl-2-imidazol-1-yl-1,3-oxazole;5-tert-butyl-3-methyl-1,2,4-oxadiazole;(2-tert-butyl-1,3-oxazol-4-yl)methanamine;[3-(4-tert-butyl-1,3-oxazol-2-yl)phenyl]-piperazin-1-ylmethanone;(5-tert-butyl-1,2-oxazol-4-yl)-piperazin-1-ylmethanone;(5-tert-butyl-1,3-oxazol-2-yl)-pyrrolidin-1-ylmethanone;2-tert-butyl-5-phenyl-1,3,4-oxadiazole;5-tert-butyl-3-phenyl-1,2-oxazole;4-tert-butyl-3-(piperazin-1-ylmethyl)-1,2-oxazol-5-amine;5-tert-butyl-3-[3-(trifluoromethyl)phenyl]-1,2,4-oxadiazole (PubChem CID 160623089) has the molecular formula C162H223ClF3N29O16P+ and a molecular weight of 2956.17 g/mol. Its IUPAC name is N-benzyl-2-tert-butyl-1,3-oxazol-5-amine;2-tert-butyl-5-chloro-4-methyl-3-phenyl-3H-pyrazol-2-ium;5-tert-butyl-2-(3-diethylphosphorylphenyl)-1,3-oxazole;4-tert-butyl-2-imidazol-1-yl-1,3-oxazole;5-tert-butyl-3-methyl-1,2,4-oxadiazole;(2-tert-butyl-1,3-oxazol-4-yl)methanamine;[3-(4-tert-butyl-1,3-oxazol-2-yl)phenyl]-piperazin-1-ylmethanone;(5-tert-butyl-1,2-oxazol-4-yl)-piperazin-1-ylmethanone;(5-tert-butyl-1,3-oxazol-2-yl)-pyrrolidin-1-ylmethanone;2-tert-butyl-5-phenyl-1,3,4-oxadiazole;5-tert-butyl-3-phenyl-1,2-oxazole;4-tert-butyl-3-(piperazin-1-ylmethyl)-1,2-oxazol-5-amine;5-tert-butyl-3-[3-(trifluoromethyl)phenyl]-1,2,4-oxadiazole.

Molecular Properties

• Compound Name: N-benzyl-2-tert-butyl-1,3-oxazol-5-amine;2-tert-butyl-5-chloro-4-methyl-3-phenyl-3H-pyrazol-2-ium;5-tert-butyl-2-(3-diethylphosphorylphenyl)-1,3-oxazole;4-tert-butyl-2-imidazol-1-yl-1,3-oxazole;5-tert-butyl-3-methyl-1,2,4-oxadiazole;(2-tert-butyl-1,3-oxazol-4-yl)methanamine;[3-(4-tert-butyl-1,3-oxazol-2-yl)phenyl]-piperazin-1-ylmethanone;(5-tert-butyl-1,2-oxazol-4-yl)-piperazin-1-ylmethanone;(5-tert-butyl-1,3-oxazol-2-yl)-pyrrolidin-1-ylmethanone;2-tert-butyl-5-phenyl-1,3,4-oxadiazole;5-tert-butyl-3-phenyl-1,2-oxazole;4-tert-butyl-3-(piperazin-1-ylmethyl)-1,2-oxazol-5-amine;5-tert-butyl-3-[3-(trifluoromethyl)phenyl]-1,2,4-oxadiazole
• PubChem CID: 160623089
• Molecular Formula: C162H223ClF3N29O16P+
• Molecular Weight: 2956.17 g/mol
• Exact Mass: 2953.69
• IUPAC Name: N-benzyl-2-tert-butyl-1,3-oxazol-5-amine;2-tert-butyl-5-chloro-4-methyl-3-phenyl-3H-pyrazol-2-ium;5-tert-butyl-2-(3-diethylphosphorylphenyl)-1,3-oxazole;4-tert-butyl-2-imidazol-1-yl-1,3-oxazole;5-tert-butyl-3-methyl-1,2,4-oxadiazole;(2-tert-butyl-1,3-oxazol-4-yl)methanamine;[3-(4-tert-butyl-1,3-oxazol-2-yl)phenyl]-piperazin-1-ylmethanone;(5-tert-butyl-1,2-oxazol-4-yl)-piperazin-1-ylmethanone;(5-tert-butyl-1,3-oxazol-2-yl)-pyrrolidin-1-ylmethanone;2-tert-butyl-5-phenyl-1,3,4-oxadiazole;5-tert-butyl-3-phenyl-1,2-oxazole;4-tert-butyl-3-(piperazin-1-ylmethyl)-1,2-oxazol-5-amine;5-tert-butyl-3-[3-(trifluoromethyl)phenyl]-1,2,4-oxadiazole
• SMILES: CC(C)(C)c1c(CN2CCNCC2)noc1N.CC(C)(C)c1cc(-c2ccccc2)no1.CC(C)(C)c1cnc(C(=O)N2CCCC2)o1.CC(C)(C)c1coc(-c2cccc(C(=O)N3CCNCC3)c2)n1.CC(C)(C)c1coc(-n2ccnc2)n1.CC(C)(C)c1nc(-c2cccc(C(F)(F)F)c2)no1.CC(C)(C)c1nc(CN)co1.CC(C)(C)c1ncc(NCc2ccccc2)o1.CC(C)(C)c1nnc(-c2ccccc2)o1.CC(C)(C)c1oncc1C(=O)N1CCNCC1.CC1=C(Cl)N=[N+](C(C)(C)C)C1c1ccccc1.CCP(=O)(CC)c1cccc(-c2ncc(C(C)(C)C)o2)c1.Cc1noc(C(C)(C)C)n1
• InChI: InChI=1S/C18H23N3O2.C17H24NO2P.C14H18ClN2.C14H18N2O.C13H13F3N2O.C13H15NO.C12H22N4O.C12H19N3O2.C12H18N2O2.C12H14N2O.C10H13N3O.C8H14N2O.C7H12N2O/c1-18(2,3)15-12-23-16(20-15)13-5-4-6-14(11-13)17(22)21-9-7-19-8-10-21;1-6-21(19,7-2)14-10-8-9-13(11-14)16-18-12-15(20-16)17(3,4)5;1-10-12(11-8-6-5-7-9-11)17(14(2,3)4)16-13(10)15;1-14(2,3)13-16-10-12(17-13)15-9-11-7-5-4-6-8-11;1-12(2,3)11-17-10(18-19-11)8-5-4-6-9(7-8)13(14,15)16;1-13(2,3)12-9-11(14-15-12)10-7-5-4-6-8-10;1-12(2,3)10-9(15-17-11(10)13)8-16-6-4-14-5-7-16;1-12(2,3)10-9(8-14-17-10)11(16)15-6-4-13-5-7-15;1-12(2,3)9-8-13-10(16-9)11(15)14-6-4-5-7-14;1-12(2,3)11-14-13-10(15-11)9-7-5-4-6-8-9;1-10(2,3)8-6-14-9(12-8)13-5-4-11-7-13;1-8(2,3)7-10-6(4-9)5-11-7;1-5-8-6(10-9-5)7(2,3)4/h4-6,11-12,19H,7-10H2,1-3H3;8-12H,6-7H2,1-5H3;5-9,12H,1-4H3;4-8,10,15H,9H2,1-3H3;4-7H,1-3H3;4-9H,1-3H3;14H,4-8,13H2,1-3H3;8,13H,4-7H2,1-3H3;8H,4-7H2,1-3H3;4-8H,1-3H3;4-7H,1-3H3;5H,4,9H2,1-3H3;1-4H3/q;;+1
• InChIKey: UOPPMBHSHRUBSE-UHFFFAOYSA-N
• XLogP: 35.59
• TPSA: 565.62 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 41
• Rotatable Bonds: 19
• Heavy Atoms: 212
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2956.17
LogP ≤ 5	35.59
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	41

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'N-C-halo', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_1', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of N-benzyl-2-tert-butyl-1,3-oxazol-5-amine;2-tert-butyl-5-chloro-4-methyl-3-phenyl-3H-pyrazol-2-ium;5-tert-butyl-2-(3-diethylphosphorylphenyl)-1,3-oxazole;4-tert-butyl-2-imidazol-1-yl-1,3-oxazole;5-tert-butyl-3-methyl-1,2,4-oxadiazole;(2-tert-butyl-1,3-oxazol-4-yl)methanamine;[3-(4-tert-butyl-1,3-oxazol-2-yl)phenyl]-piperazin-1-ylmethanone;(5-tert-butyl-1,2-oxazol-4-yl)-piperazin-1-ylmethanone;(5-tert-butyl-1,3-oxazol-2-yl)-pyrrolidin-1-ylmethanone;2-tert-butyl-5-phenyl-1,3,4-oxadiazole;5-tert-butyl-3-phenyl-1,2-oxazole;4-tert-butyl-3-(piperazin-1-ylmethyl)-1,2-oxazol-5-amine;5-tert-butyl-3-[3-(trifluoromethyl)phenyl]-1,2,4-oxadiazole?

The IUPAC name of N-benzyl-2-tert-butyl-1,3-oxazol-5-amine;2-tert-butyl-5-chloro-4-methyl-3-phenyl-3H-pyrazol-2-ium;5-tert-butyl-2-(3-diethylphosphorylphenyl)-1,3-oxazole;4-tert-butyl-2-imidazol-1-yl-1,3-oxazole;5-tert-butyl-3-methyl-1,2,4-oxadiazole;(2-tert-butyl-1,3-oxazol-4-yl)methanamine;[3-(4-tert-butyl-1,3-oxazol-2-yl)phenyl]-piperazin-1-ylmethanone;(5-tert-butyl-1,2-oxazol-4-yl)-piperazin-1-ylmethanone;(5-tert-butyl-1,3-oxazol-2-yl)-pyrrolidin-1-ylmethanone;2-tert-butyl-5-phenyl-1,3,4-oxadiazole;5-tert-butyl-3-phenyl-1,2-oxazole;4-tert-butyl-3-(piperazin-1-ylmethyl)-1,2-oxazol-5-amine;5-tert-butyl-3-[3-(trifluoromethyl)phenyl]-1,2,4-oxadiazole (CID 160623089) is N-benzyl-2-tert-butyl-1,3-oxazol-5-amine;2-tert-butyl-5-chloro-4-methyl-3-phenyl-3H-pyrazol-2-ium;5-tert-butyl-2-(3-diethylphosphorylphenyl)-1,3-oxazole;4-tert-butyl-2-imidazol-1-yl-1,3-oxazole;5-tert-butyl-3-methyl-1,2,4-oxadiazole;(2-tert-butyl-1,3-oxazol-4-yl)methanamine;[3-(4-tert-butyl-1,3-oxazol-2-yl)phenyl]-piperazin-1-ylmethanone;(5-tert-butyl-1,2-oxazol-4-yl)-piperazin-1-ylmethanone;(5-tert-butyl-1,3-oxazol-2-yl)-pyrrolidin-1-ylmethanone;2-tert-butyl-5-phenyl-1,3,4-oxadiazole;5-tert-butyl-3-phenyl-1,2-oxazole;4-tert-butyl-3-(piperazin-1-ylmethyl)-1,2-oxazol-5-amine;5-tert-butyl-3-[3-(trifluoromethyl)phenyl]-1,2,4-oxadiazole.

What is the SMILES notation for N-benzyl-2-tert-butyl-1,3-oxazol-5-amine;2-tert-butyl-5-chloro-4-methyl-3-phenyl-3H-pyrazol-2-ium;5-tert-butyl-2-(3-diethylphosphorylphenyl)-1,3-oxazole;4-tert-butyl-2-imidazol-1-yl-1,3-oxazole;5-tert-butyl-3-methyl-1,2,4-oxadiazole;(2-tert-butyl-1,3-oxazol-4-yl)methanamine;[3-(4-tert-butyl-1,3-oxazol-2-yl)phenyl]-piperazin-1-ylmethanone;(5-tert-butyl-1,2-oxazol-4-yl)-piperazin-1-ylmethanone;(5-tert-butyl-1,3-oxazol-2-yl)-pyrrolidin-1-ylmethanone;2-tert-butyl-5-phenyl-1,3,4-oxadiazole;5-tert-butyl-3-phenyl-1,2-oxazole;4-tert-butyl-3-(piperazin-1-ylmethyl)-1,2-oxazol-5-amine;5-tert-butyl-3-[3-(trifluoromethyl)phenyl]-1,2,4-oxadiazole?

The canonical SMILES for N-benzyl-2-tert-butyl-1,3-oxazol-5-amine;2-tert-butyl-5-chloro-4-methyl-3-phenyl-3H-pyrazol-2-ium;5-tert-butyl-2-(3-diethylphosphorylphenyl)-1,3-oxazole;4-tert-butyl-2-imidazol-1-yl-1,3-oxazole;5-tert-butyl-3-methyl-1,2,4-oxadiazole;(2-tert-butyl-1,3-oxazol-4-yl)methanamine;[3-(4-tert-butyl-1,3-oxazol-2-yl)phenyl]-piperazin-1-ylmethanone;(5-tert-butyl-1,2-oxazol-4-yl)-piperazin-1-ylmethanone;(5-tert-butyl-1,3-oxazol-2-yl)-pyrrolidin-1-ylmethanone;2-tert-butyl-5-phenyl-1,3,4-oxadiazole;5-tert-butyl-3-phenyl-1,2-oxazole;4-tert-butyl-3-(piperazin-1-ylmethyl)-1,2-oxazol-5-amine;5-tert-butyl-3-[3-(trifluoromethyl)phenyl]-1,2,4-oxadiazole is CC(C)(C)c1c(CN2CCNCC2)noc1N.CC(C)(C)c1cc(-c2ccccc2)no1.CC(C)(C)c1cnc(C(=O)N2CCCC2)o1.CC(C)(C)c1coc(-c2cccc(C(=O)N3CCNCC3)c2)n1.CC(C)(C)c1coc(-n2ccnc2)n1.CC(C)(C)c1nc(-c2cccc(C(F)(F)F)c2)no1.CC(C)(C)c1nc(CN)co1.CC(C)(C)c1ncc(NCc2ccccc2)o1.CC(C)(C)c1nnc(-c2ccccc2)o1.CC(C)(C)c1oncc1C(=O)N1CCNCC1.CC1=C(Cl)N=[N+](C(C)(C)C)C1c1ccccc1.CCP(=O)(CC)c1cccc(-c2ncc(C(C)(C)C)o2)c1.Cc1noc(C(C)(C)C)n1.

What is the InChIKey of N-benzyl-2-tert-butyl-1,3-oxazol-5-amine;2-tert-butyl-5-chloro-4-methyl-3-phenyl-3H-pyrazol-2-ium;5-tert-butyl-2-(3-diethylphosphorylphenyl)-1,3-oxazole;4-tert-butyl-2-imidazol-1-yl-1,3-oxazole;5-tert-butyl-3-methyl-1,2,4-oxadiazole;(2-tert-butyl-1,3-oxazol-4-yl)methanamine;[3-(4-tert-butyl-1,3-oxazol-2-yl)phenyl]-piperazin-1-ylmethanone;(5-tert-butyl-1,2-oxazol-4-yl)-piperazin-1-ylmethanone;(5-tert-butyl-1,3-oxazol-2-yl)-pyrrolidin-1-ylmethanone;2-tert-butyl-5-phenyl-1,3,4-oxadiazole;5-tert-butyl-3-phenyl-1,2-oxazole;4-tert-butyl-3-(piperazin-1-ylmethyl)-1,2-oxazol-5-amine;5-tert-butyl-3-[3-(trifluoromethyl)phenyl]-1,2,4-oxadiazole?

The InChIKey is UOPPMBHSHRUBSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N3O2.C17H24NO2P.C14H18ClN2.C14H18N2O.C13H13F3N2O.C13H15NO.C12H22N4O.C12H19N3O2.C12H18N2O2.C12H14N2O.C10H13N3O.C8H14N2O.C7H12N2O/c1-18(2,3)15-12-23-16(20-15)13-5-4-6-14(11-13)17(22)21-9-7-19-8-10-21;1-6-21(19,7-2)14-10-8-9-13(11-14)16-18-12-15(20-16)17(3,4)5;1-10-12(11-8-6-5-7-9-11)17(14(2,3)4)16-13(10)15;1-14(2,3)13-16-10-12(17-13)15-9-11-7-5-4-6-8-11;1-12(2,3)11-17-10(18-19-11)8-5-4-6-9(7-8)13(14,15)16;1-13(2,3)12-9-11(14-15-12)10-7-5-4-6-8-10;1-12(2,3)10-9(15-17-11(10)13)8-16-6-4-14-5-7-16;1-12(2,3)10-9(8-14-17-10)11(16)15-6-4-13-5-7-15;1-12(2,3)9-8-13-10(16-9)11(15)14-6-4-5-7-14;1-12(2,3)11-14-13-10(15-11)9-7-5-4-6-8-9;1-10(2,3)8-6-14-9(12-8)13-5-4-11-7-13;1-8(2,3)7-10-6(4-9)5-11-7;1-5-8-6(10-9-5)7(2,3)4/h4-6,11-12,19H,7-10H2,1-3H3;8-12H,6-7H2,1-5H3;5-9,12H,1-4H3;4-8,10,15H,9H2,1-3H3;4-7H,1-3H3;4-9H,1-3H3;14H,4-8,13H2,1-3H3;8,13H,4-7H2,1-3H3;8H,4-7H2,1-3H3;4-8H,1-3H3;4-7H,1-3H3;5H,4,9H2,1-3H3;1-4H3/q;;+1;;;;;;;;;;.

What are the key properties of N-benzyl-2-tert-butyl-1,3-oxazol-5-amine;2-tert-butyl-5-chloro-4-methyl-3-phenyl-3H-pyrazol-2-ium;5-tert-butyl-2-(3-diethylphosphorylphenyl)-1,3-oxazole;4-tert-butyl-2-imidazol-1-yl-1,3-oxazole;5-tert-butyl-3-methyl-1,2,4-oxadiazole;(2-tert-butyl-1,3-oxazol-4-yl)methanamine;[3-(4-tert-butyl-1,3-oxazol-2-yl)phenyl]-piperazin-1-ylmethanone;(5-tert-butyl-1,2-oxazol-4-yl)-piperazin-1-ylmethanone;(5-tert-butyl-1,3-oxazol-2-yl)-pyrrolidin-1-ylmethanone;2-tert-butyl-5-phenyl-1,3,4-oxadiazole;5-tert-butyl-3-phenyl-1,2-oxazole;4-tert-butyl-3-(piperazin-1-ylmethyl)-1,2-oxazol-5-amine;5-tert-butyl-3-[3-(trifluoromethyl)phenyl]-1,2,4-oxadiazole?

N-benzyl-2-tert-butyl-1,3-oxazol-5-amine;2-tert-butyl-5-chloro-4-methyl-3-phenyl-3H-pyrazol-2-ium;5-tert-butyl-2-(3-diethylphosphorylphenyl)-1,3-oxazole;4-tert-butyl-2-imidazol-1-yl-1,3-oxazole;5-tert-butyl-3-methyl-1,2,4-oxadiazole;(2-tert-butyl-1,3-oxazol-4-yl)methanamine;[3-(4-tert-butyl-1,3-oxazol-2-yl)phenyl]-piperazin-1-ylmethanone;(5-tert-butyl-1,2-oxazol-4-yl)-piperazin-1-ylmethanone;(5-tert-butyl-1,3-oxazol-2-yl)-pyrrolidin-1-ylmethanone;2-tert-butyl-5-phenyl-1,3,4-oxadiazole;5-tert-butyl-3-phenyl-1,2-oxazole;4-tert-butyl-3-(piperazin-1-ylmethyl)-1,2-oxazol-5-amine;5-tert-butyl-3-[3-(trifluoromethyl)phenyl]-1,2,4-oxadiazole has a molecular weight of 2956.17 g/mol, XLogP of 35.59, 19 rotatable bonds, 6 hydrogen bond donors, and 41 hydrogen bond acceptors.

Where does this data come from?

All data for N-benzyl-2-tert-butyl-1,3-oxazol-5-amine;2-tert-butyl-5-chloro-4-methyl-3-phenyl-3H-pyrazol-2-ium;5-tert-butyl-2-(3-diethylphosphorylphenyl)-1,3-oxazole;4-tert-butyl-2-imidazol-1-yl-1,3-oxazole;5-tert-butyl-3-methyl-1,2,4-oxadiazole;(2-tert-butyl-1,3-oxazol-4-yl)methanamine;[3-(4-tert-butyl-1,3-oxazol-2-yl)phenyl]-piperazin-1-ylmethanone;(5-tert-butyl-1,2-oxazol-4-yl)-piperazin-1-ylmethanone;(5-tert-butyl-1,3-oxazol-2-yl)-pyrrolidin-1-ylmethanone;2-tert-butyl-5-phenyl-1,3,4-oxadiazole;5-tert-butyl-3-phenyl-1,2-oxazole;4-tert-butyl-3-(piperazin-1-ylmethyl)-1,2-oxazol-5-amine;5-tert-butyl-3-[3-(trifluoromethyl)phenyl]-1,2,4-oxadiazole is sourced from PubChem (CID 160623089), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).