3-benzyl-5-(2,2-dimethylpropyl)-1,2,4-oxadiazole;5-tert-butyl-2-(2,2-dimethylpropyl)-1,3-oxazole;5-chloro-2-(3,3-dimethylbutoxy)pyrimidine;5-chloro-2-(2,2-dimethylpropyl)pyrimidine;2-cyclobutyl-4-(2,2-dimethylpropyl)-1,3-oxazole;5-cyclopropyl-3-(2,2-dimethylpropyl)-1,2,4-oxadiazole;2-cyclopropyl-4-(2,2-dimethylpropyl)-1,3-oxazole;2-(3,3-dimethylbutoxy)pyridine;2-(3,3-dimethylbutoxy)pyrimidine;2-(3,3-dimethylbutyl)-6-methylpyridine;2-(3,3-dimethylbutyl)pyridine;2-(3,3-dimethylbutyl)pyrimidine;4-(3,3-dimethylbutyl)pyrimidine;2-(2,2-dimethylpropyl)-4,5-dimethyl-1,3-oxazole;bis(3-(2,2-dimethylpropyl)-5-methyl-1,2,4-oxadiazole);bis(5-(2,2-dimethylpropyl)-3-methyl-1,2,4-oxadiazole);2-(2,2-dimethylpropyl)-4-methyl-1,3-oxazole;2-(2,2-dimethylpropyl)-5-methyl-1,3-oxazole;5-(2,2-dimethylpropyl)-2-methyl-1,3-oxazole;bis(5-(2,2-dimethylpropyl)-3-methyl-1,2-oxazole);5-(2,2-dimethylpropyl)-3-phenyl-1,2-oxazole;2-(2,2-dimethylpropyl)pyridine;bis(2-(2,2-dimethylpropyl)pyrimidine)

C271H428Cl2N40O19 — CID 158223673

About 3-benzyl-5-(2,2-dimethylpropyl)-1,2,4-oxadiazole;5-tert-butyl-2-(2,2-dimethylpropyl)-1,3-oxazole;5-chloro-2-(3,3-dimethylbutoxy)pyrimidine;5-chloro-2-(2,2-dimethylpropyl)pyrimidine;2-cyclobutyl-4-(2,2-dimethylpropyl)-1,3-oxazole;5-cyclopropyl-3-(2,2-dimethylpropyl)-1,2,4-oxadiazole;2-cyclopropyl-4-(2,2-dimethylpropyl)-1,3-oxazole;2-(3,3-dimethylbutoxy)pyridine;2-(3,3-dimethylbutoxy)pyrimidine;2-(3,3-dimethylbutyl)-6-methylpyridine;2-(3,3-dimethylbutyl)pyridine;2-(3,3-dimethylbutyl)pyrimidine;4-(3,3-dimethylbutyl)pyrimidine;2-(2,2-dimethylpropyl)-4,5-dimethyl-1,3-oxazole;bis(3-(2,2-dimethylpropyl)-5-methyl-1,2,4-oxadiazole);bis(5-(2,2-dimethylpropyl)-3-methyl-1,2,4-oxadiazole);2-(2,2-dimethylpropyl)-4-methyl-1,3-oxazole;2-(2,2-dimethylpropyl)-5-methyl-1,3-oxazole;5-(2,2-dimethylpropyl)-2-methyl-1,3-oxazole;bis(5-(2,2-dimethylpropyl)-3-methyl-1,2-oxazole);5-(2,2-dimethylpropyl)-3-phenyl-1,2-oxazole;2-(2,2-dimethylpropyl)pyridine;bis(2-(2,2-dimethylpropyl)pyrimidine)

3-benzyl-5-(2,2-dimethylpropyl)-1,2,4-oxadiazole;5-tert-butyl-2-(2,2-dimethylpropyl)-1,3-oxazole;5-chloro-2-(3,3-dimethylbutoxy)pyrimidine;5-chloro-2-(2,2-dimethylpropyl)pyrimidine;2-cyclobutyl-4-(2,2-dimethylpropyl)-1,3-oxazole;5-cyclopropyl-3-(2,2-dimethylpropyl)-1,2,4-oxadiazole;2-cyclopropyl-4-(2,2-dimethylpropyl)-1,3-oxazole;2-(3,3-dimethylbutoxy)pyridine;2-(3,3-dimethylbutoxy)pyrimidine;2-(3,3-dimethylbutyl)-6-methylpyridine;2-(3,3-dimethylbutyl)pyridine;2-(3,3-dimethylbutyl)pyrimidine;4-(3,3-dimethylbutyl)pyrimidine;2-(2,2-dimethylpropyl)-4,5-dimethyl-1,3-oxazole;bis(3-(2,2-dimethylpropyl)-5-methyl-1,2,4-oxadiazole);bis(5-(2,2-dimethylpropyl)-3-methyl-1,2,4-oxadiazole);2-(2,2-dimethylpropyl)-4-methyl-1,3-oxazole;2-(2,2-dimethylpropyl)-5-methyl-1,3-oxazole;5-(2,2-dimethylpropyl)-2-methyl-1,3-oxazole;bis(5-(2,2-dimethylpropyl)-3-methyl-1,2-oxazole);5-(2,2-dimethylpropyl)-3-phenyl-1,2-oxazole;2-(2,2-dimethylpropyl)pyridine;bis(2-(2,2-dimethylpropyl)pyrimidine) (PubChem CID 158223673) has the molecular formula C271H428Cl2N40O19 and a molecular weight of 4621.57 g/mol. Its IUPAC name is 3-benzyl-5-(2,2-dimethylpropyl)-1,2,4-oxadiazole;5-tert-butyl-2-(2,2-dimethylpropyl)-1,3-oxazole;5-chloro-2-(3,3-dimethylbutoxy)pyrimidine;5-chloro-2-(2,2-dimethylpropyl)pyrimidine;2-cyclobutyl-4-(2,2-dimethylpropyl)-1,3-oxazole;5-cyclopropyl-3-(2,2-dimethylpropyl)-1,2,4-oxadiazole;2-cyclopropyl-4-(2,2-dimethylpropyl)-1,3-oxazole;2-(3,3-dimethylbutoxy)pyridine;2-(3,3-dimethylbutoxy)pyrimidine;2-(3,3-dimethylbutyl)-6-methylpyridine;2-(3,3-dimethylbutyl)pyridine;2-(3,3-dimethylbutyl)pyrimidine;4-(3,3-dimethylbutyl)pyrimidine;2-(2,2-dimethylpropyl)-4,5-dimethyl-1,3-oxazole;bis(3-(2,2-dimethylpropyl)-5-methyl-1,2,4-oxadiazole);bis(5-(2,2-dimethylpropyl)-3-methyl-1,2,4-oxadiazole);2-(2,2-dimethylpropyl)-4-methyl-1,3-oxazole;2-(2,2-dimethylpropyl)-5-methyl-1,3-oxazole;5-(2,2-dimethylpropyl)-2-methyl-1,3-oxazole;bis(5-(2,2-dimethylpropyl)-3-methyl-1,2-oxazole);5-(2,2-dimethylpropyl)-3-phenyl-1,2-oxazole;2-(2,2-dimethylpropyl)pyridine;bis(2-(2,2-dimethylpropyl)pyrimidine).

Molecular Properties

• Compound Name: 3-benzyl-5-(2,2-dimethylpropyl)-1,2,4-oxadiazole;5-tert-butyl-2-(2,2-dimethylpropyl)-1,3-oxazole;5-chloro-2-(3,3-dimethylbutoxy)pyrimidine;5-chloro-2-(2,2-dimethylpropyl)pyrimidine;2-cyclobutyl-4-(2,2-dimethylpropyl)-1,3-oxazole;5-cyclopropyl-3-(2,2-dimethylpropyl)-1,2,4-oxadiazole;2-cyclopropyl-4-(2,2-dimethylpropyl)-1,3-oxazole;2-(3,3-dimethylbutoxy)pyridine;2-(3,3-dimethylbutoxy)pyrimidine;2-(3,3-dimethylbutyl)-6-methylpyridine;2-(3,3-dimethylbutyl)pyridine;2-(3,3-dimethylbutyl)pyrimidine;4-(3,3-dimethylbutyl)pyrimidine;2-(2,2-dimethylpropyl)-4,5-dimethyl-1,3-oxazole;bis(3-(2,2-dimethylpropyl)-5-methyl-1,2,4-oxadiazole);bis(5-(2,2-dimethylpropyl)-3-methyl-1,2,4-oxadiazole);2-(2,2-dimethylpropyl)-4-methyl-1,3-oxazole;2-(2,2-dimethylpropyl)-5-methyl-1,3-oxazole;5-(2,2-dimethylpropyl)-2-methyl-1,3-oxazole;bis(5-(2,2-dimethylpropyl)-3-methyl-1,2-oxazole);5-(2,2-dimethylpropyl)-3-phenyl-1,2-oxazole;2-(2,2-dimethylpropyl)pyridine;bis(2-(2,2-dimethylpropyl)pyrimidine)
• PubChem CID: 158223673
• Molecular Formula: C271H428Cl2N40O19
• Molecular Weight: 4621.57 g/mol
• Exact Mass: 4617.31
• IUPAC Name: 3-benzyl-5-(2,2-dimethylpropyl)-1,2,4-oxadiazole;5-tert-butyl-2-(2,2-dimethylpropyl)-1,3-oxazole;5-chloro-2-(3,3-dimethylbutoxy)pyrimidine;5-chloro-2-(2,2-dimethylpropyl)pyrimidine;2-cyclobutyl-4-(2,2-dimethylpropyl)-1,3-oxazole;5-cyclopropyl-3-(2,2-dimethylpropyl)-1,2,4-oxadiazole;2-cyclopropyl-4-(2,2-dimethylpropyl)-1,3-oxazole;2-(3,3-dimethylbutoxy)pyridine;2-(3,3-dimethylbutoxy)pyrimidine;2-(3,3-dimethylbutyl)-6-methylpyridine;2-(3,3-dimethylbutyl)pyridine;2-(3,3-dimethylbutyl)pyrimidine;4-(3,3-dimethylbutyl)pyrimidine;2-(2,2-dimethylpropyl)-4,5-dimethyl-1,3-oxazole;bis(3-(2,2-dimethylpropyl)-5-methyl-1,2,4-oxadiazole);bis(5-(2,2-dimethylpropyl)-3-methyl-1,2,4-oxadiazole);2-(2,2-dimethylpropyl)-4-methyl-1,3-oxazole;2-(2,2-dimethylpropyl)-5-methyl-1,3-oxazole;5-(2,2-dimethylpropyl)-2-methyl-1,3-oxazole;bis(5-(2,2-dimethylpropyl)-3-methyl-1,2-oxazole);5-(2,2-dimethylpropyl)-3-phenyl-1,2-oxazole;2-(2,2-dimethylpropyl)pyridine;bis(2-(2,2-dimethylpropyl)pyrimidine)
• SMILES: CC(C)(C)CCOc1ccccn1.CC(C)(C)CCOc1ncc(Cl)cn1.CC(C)(C)CCOc1ncccn1.CC(C)(C)CCc1ccccn1.CC(C)(C)CCc1ccncn1.CC(C)(C)CCc1ncccn1.CC(C)(C)Cc1cc(-c2ccccc2)no1.CC(C)(C)Cc1ccccn1.CC(C)(C)Cc1coc(C2CC2)n1.CC(C)(C)Cc1coc(C2CCC2)n1.CC(C)(C)Cc1nc(Cc2ccccc2)no1.CC(C)(C)Cc1ncc(C(C)(C)C)o1.CC(C)(C)Cc1ncc(Cl)cn1.CC(C)(C)Cc1ncccn1.CC(C)(C)Cc1ncccn1.CC(C)(C)Cc1noc(C2CC2)n1.Cc1cc(CC(C)(C)C)on1.Cc1cc(CC(C)(C)C)on1.Cc1cccc(CCC(C)(C)C)n1.Cc1cnc(CC(C)(C)C)o1.Cc1coc(CC(C)(C)C)n1.Cc1nc(CC(C)(C)C)no1.Cc1nc(CC(C)(C)C)no1.Cc1nc(CC(C)(C)C)oc1C.Cc1ncc(CC(C)(C)C)o1.Cc1noc(CC(C)(C)C)n1.Cc1noc(CC(C)(C)C)n1
• InChI: InChI=1S/C14H18N2O.C14H17NO.C12H19NO.C12H21NO.C12H19N.2C11H17NO.C11H17N.C10H15ClN2O.2C10H16N2O.2C10H16N2.C10H17NO.C10H15N.C9H13ClN2.2C9H14N2.5C9H15NO.4C8H14N2O/c1-14(2,3)10-13-15-12(16-17-13)9-11-7-5-4-6-8-11;1-14(2,3)10-12-9-13(15-16-12)11-7-5-4-6-8-11;1-12(2,3)7-10-8-14-11(13-10)9-5-4-6-9;1-11(2,3)7-10-13-8-9(14-10)12(4,5)6;1-10-6-5-7-11(13-10)8-9-12(2,3)4;1-11(2,3)6-9-7-13-10(12-9)8-4-5-8;1-11(2,3)7-9-13-10-6-4-5-8-12-10;1-11(2,3)8-7-10-6-4-5-9-12-10;1-10(2,3)4-5-14-9-12-6-8(11)7-13-9;1-10(2,3)6-8-11-9(13-12-8)7-4-5-7;1-10(2,3)5-8-13-9-11-6-4-7-12-9;1-10(2,3)6-5-9-11-7-4-8-12-9;1-10(2,3)6-4-9-5-7-11-8-12-9;1-7-8(2)12-9(11-7)6-10(3,4)5;1-10(2,3)8-9-6-4-5-7-11-9;1-9(2,3)4-8-11-5-7(10)6-12-8;2*1-9(2,3)7-8-10-5-4-6-11-8;1-7-10-6-8(11-7)5-9(2,3)4;1-7-6-11-8(10-7)5-9(2,3)4;1-7-6-10-8(11-7)5-9(2,3)4;2*1-7-5-8(11-10-7)6-9(2,3)4;2*1-6-9-7(10-11-6)5-8(2,3)4;2*1-6-9-7(11-10-6)5-8(2,3)4/h4-8H,9-10H2,1-3H3;4-9H,10H2,1-3H3;8-9H,4-7H2,1-3H3;8H,7H2,1-6H3;5-7H,8-9H2,1-4H3;7-8H,4-6H2,1-3H3;4-6,8H,7,9H2,1-3H3;4-6,9H,7-8H2,1-3H3;6-7H,4-5H2,1-3H3;7H,4-6H2,1-3H3;4,6-7H,5,8H2,1-3H3;4,7-8H,5-6H2,1-3H3;5,7-8H,4,6H2,1-3H3;6H2,1-5H3;4-7H,8H2,1-3H3;5-6H,4H2,1-3H3;2*4-6H,7H2,1-3H3;3*6H,5H2,1-4H3;2*5H,6H2,1-4H3;4*5H2,1-4H3
• InChIKey: GDNVHDZEDDVJRQ-UHFFFAOYSA-N
• XLogP: 72.54
• TPSA: 753.53 Ų
• H-Bond Acceptors: 59
• Rotatable Bonds: 43
• Heavy Atoms: 332
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	4621.57
LogP ≤ 5	72.54
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	59

Frequently Asked Questions

What is the IUPAC name of 3-benzyl-5-(2,2-dimethylpropyl)-1,2,4-oxadiazole;5-tert-butyl-2-(2,2-dimethylpropyl)-1,3-oxazole;5-chloro-2-(3,3-dimethylbutoxy)pyrimidine;5-chloro-2-(2,2-dimethylpropyl)pyrimidine;2-cyclobutyl-4-(2,2-dimethylpropyl)-1,3-oxazole;5-cyclopropyl-3-(2,2-dimethylpropyl)-1,2,4-oxadiazole;2-cyclopropyl-4-(2,2-dimethylpropyl)-1,3-oxazole;2-(3,3-dimethylbutoxy)pyridine;2-(3,3-dimethylbutoxy)pyrimidine;2-(3,3-dimethylbutyl)-6-methylpyridine;2-(3,3-dimethylbutyl)pyridine;2-(3,3-dimethylbutyl)pyrimidine;4-(3,3-dimethylbutyl)pyrimidine;2-(2,2-dimethylpropyl)-4,5-dimethyl-1,3-oxazole;bis(3-(2,2-dimethylpropyl)-5-methyl-1,2,4-oxadiazole);bis(5-(2,2-dimethylpropyl)-3-methyl-1,2,4-oxadiazole);2-(2,2-dimethylpropyl)-4-methyl-1,3-oxazole;2-(2,2-dimethylpropyl)-5-methyl-1,3-oxazole;5-(2,2-dimethylpropyl)-2-methyl-1,3-oxazole;bis(5-(2,2-dimethylpropyl)-3-methyl-1,2-oxazole);5-(2,2-dimethylpropyl)-3-phenyl-1,2-oxazole;2-(2,2-dimethylpropyl)pyridine;bis(2-(2,2-dimethylpropyl)pyrimidine)?

The IUPAC name of 3-benzyl-5-(2,2-dimethylpropyl)-1,2,4-oxadiazole;5-tert-butyl-2-(2,2-dimethylpropyl)-1,3-oxazole;5-chloro-2-(3,3-dimethylbutoxy)pyrimidine;5-chloro-2-(2,2-dimethylpropyl)pyrimidine;2-cyclobutyl-4-(2,2-dimethylpropyl)-1,3-oxazole;5-cyclopropyl-3-(2,2-dimethylpropyl)-1,2,4-oxadiazole;2-cyclopropyl-4-(2,2-dimethylpropyl)-1,3-oxazole;2-(3,3-dimethylbutoxy)pyridine;2-(3,3-dimethylbutoxy)pyrimidine;2-(3,3-dimethylbutyl)-6-methylpyridine;2-(3,3-dimethylbutyl)pyridine;2-(3,3-dimethylbutyl)pyrimidine;4-(3,3-dimethylbutyl)pyrimidine;2-(2,2-dimethylpropyl)-4,5-dimethyl-1,3-oxazole;bis(3-(2,2-dimethylpropyl)-5-methyl-1,2,4-oxadiazole);bis(5-(2,2-dimethylpropyl)-3-methyl-1,2,4-oxadiazole);2-(2,2-dimethylpropyl)-4-methyl-1,3-oxazole;2-(2,2-dimethylpropyl)-5-methyl-1,3-oxazole;5-(2,2-dimethylpropyl)-2-methyl-1,3-oxazole;bis(5-(2,2-dimethylpropyl)-3-methyl-1,2-oxazole);5-(2,2-dimethylpropyl)-3-phenyl-1,2-oxazole;2-(2,2-dimethylpropyl)pyridine;bis(2-(2,2-dimethylpropyl)pyrimidine) (CID 158223673) is 3-benzyl-5-(2,2-dimethylpropyl)-1,2,4-oxadiazole;5-tert-butyl-2-(2,2-dimethylpropyl)-1,3-oxazole;5-chloro-2-(3,3-dimethylbutoxy)pyrimidine;5-chloro-2-(2,2-dimethylpropyl)pyrimidine;2-cyclobutyl-4-(2,2-dimethylpropyl)-1,3-oxazole;5-cyclopropyl-3-(2,2-dimethylpropyl)-1,2,4-oxadiazole;2-cyclopropyl-4-(2,2-dimethylpropyl)-1,3-oxazole;2-(3,3-dimethylbutoxy)pyridine;2-(3,3-dimethylbutoxy)pyrimidine;2-(3,3-dimethylbutyl)-6-methylpyridine;2-(3,3-dimethylbutyl)pyridine;2-(3,3-dimethylbutyl)pyrimidine;4-(3,3-dimethylbutyl)pyrimidine;2-(2,2-dimethylpropyl)-4,5-dimethyl-1,3-oxazole;bis(3-(2,2-dimethylpropyl)-5-methyl-1,2,4-oxadiazole);bis(5-(2,2-dimethylpropyl)-3-methyl-1,2,4-oxadiazole);2-(2,2-dimethylpropyl)-4-methyl-1,3-oxazole;2-(2,2-dimethylpropyl)-5-methyl-1,3-oxazole;5-(2,2-dimethylpropyl)-2-methyl-1,3-oxazole;bis(5-(2,2-dimethylpropyl)-3-methyl-1,2-oxazole);5-(2,2-dimethylpropyl)-3-phenyl-1,2-oxazole;2-(2,2-dimethylpropyl)pyridine;bis(2-(2,2-dimethylpropyl)pyrimidine).

What is the SMILES notation for 3-benzyl-5-(2,2-dimethylpropyl)-1,2,4-oxadiazole;5-tert-butyl-2-(2,2-dimethylpropyl)-1,3-oxazole;5-chloro-2-(3,3-dimethylbutoxy)pyrimidine;5-chloro-2-(2,2-dimethylpropyl)pyrimidine;2-cyclobutyl-4-(2,2-dimethylpropyl)-1,3-oxazole;5-cyclopropyl-3-(2,2-dimethylpropyl)-1,2,4-oxadiazole;2-cyclopropyl-4-(2,2-dimethylpropyl)-1,3-oxazole;2-(3,3-dimethylbutoxy)pyridine;2-(3,3-dimethylbutoxy)pyrimidine;2-(3,3-dimethylbutyl)-6-methylpyridine;2-(3,3-dimethylbutyl)pyridine;2-(3,3-dimethylbutyl)pyrimidine;4-(3,3-dimethylbutyl)pyrimidine;2-(2,2-dimethylpropyl)-4,5-dimethyl-1,3-oxazole;bis(3-(2,2-dimethylpropyl)-5-methyl-1,2,4-oxadiazole);bis(5-(2,2-dimethylpropyl)-3-methyl-1,2,4-oxadiazole);2-(2,2-dimethylpropyl)-4-methyl-1,3-oxazole;2-(2,2-dimethylpropyl)-5-methyl-1,3-oxazole;5-(2,2-dimethylpropyl)-2-methyl-1,3-oxazole;bis(5-(2,2-dimethylpropyl)-3-methyl-1,2-oxazole);5-(2,2-dimethylpropyl)-3-phenyl-1,2-oxazole;2-(2,2-dimethylpropyl)pyridine;bis(2-(2,2-dimethylpropyl)pyrimidine)?

The canonical SMILES for 3-benzyl-5-(2,2-dimethylpropyl)-1,2,4-oxadiazole;5-tert-butyl-2-(2,2-dimethylpropyl)-1,3-oxazole;5-chloro-2-(3,3-dimethylbutoxy)pyrimidine;5-chloro-2-(2,2-dimethylpropyl)pyrimidine;2-cyclobutyl-4-(2,2-dimethylpropyl)-1,3-oxazole;5-cyclopropyl-3-(2,2-dimethylpropyl)-1,2,4-oxadiazole;2-cyclopropyl-4-(2,2-dimethylpropyl)-1,3-oxazole;2-(3,3-dimethylbutoxy)pyridine;2-(3,3-dimethylbutoxy)pyrimidine;2-(3,3-dimethylbutyl)-6-methylpyridine;2-(3,3-dimethylbutyl)pyridine;2-(3,3-dimethylbutyl)pyrimidine;4-(3,3-dimethylbutyl)pyrimidine;2-(2,2-dimethylpropyl)-4,5-dimethyl-1,3-oxazole;bis(3-(2,2-dimethylpropyl)-5-methyl-1,2,4-oxadiazole);bis(5-(2,2-dimethylpropyl)-3-methyl-1,2,4-oxadiazole);2-(2,2-dimethylpropyl)-4-methyl-1,3-oxazole;2-(2,2-dimethylpropyl)-5-methyl-1,3-oxazole;5-(2,2-dimethylpropyl)-2-methyl-1,3-oxazole;bis(5-(2,2-dimethylpropyl)-3-methyl-1,2-oxazole);5-(2,2-dimethylpropyl)-3-phenyl-1,2-oxazole;2-(2,2-dimethylpropyl)pyridine;bis(2-(2,2-dimethylpropyl)pyrimidine) is CC(C)(C)CCOc1ccccn1.CC(C)(C)CCOc1ncc(Cl)cn1.CC(C)(C)CCOc1ncccn1.CC(C)(C)CCc1ccccn1.CC(C)(C)CCc1ccncn1.CC(C)(C)CCc1ncccn1.CC(C)(C)Cc1cc(-c2ccccc2)no1.CC(C)(C)Cc1ccccn1.CC(C)(C)Cc1coc(C2CC2)n1.CC(C)(C)Cc1coc(C2CCC2)n1.CC(C)(C)Cc1nc(Cc2ccccc2)no1.CC(C)(C)Cc1ncc(C(C)(C)C)o1.CC(C)(C)Cc1ncc(Cl)cn1.CC(C)(C)Cc1ncccn1.CC(C)(C)Cc1ncccn1.CC(C)(C)Cc1noc(C2CC2)n1.Cc1cc(CC(C)(C)C)on1.Cc1cc(CC(C)(C)C)on1.Cc1cccc(CCC(C)(C)C)n1.Cc1cnc(CC(C)(C)C)o1.Cc1coc(CC(C)(C)C)n1.Cc1nc(CC(C)(C)C)no1.Cc1nc(CC(C)(C)C)no1.Cc1nc(CC(C)(C)C)oc1C.Cc1ncc(CC(C)(C)C)o1.Cc1noc(CC(C)(C)C)n1.Cc1noc(CC(C)(C)C)n1.

What is the InChIKey of 3-benzyl-5-(2,2-dimethylpropyl)-1,2,4-oxadiazole;5-tert-butyl-2-(2,2-dimethylpropyl)-1,3-oxazole;5-chloro-2-(3,3-dimethylbutoxy)pyrimidine;5-chloro-2-(2,2-dimethylpropyl)pyrimidine;2-cyclobutyl-4-(2,2-dimethylpropyl)-1,3-oxazole;5-cyclopropyl-3-(2,2-dimethylpropyl)-1,2,4-oxadiazole;2-cyclopropyl-4-(2,2-dimethylpropyl)-1,3-oxazole;2-(3,3-dimethylbutoxy)pyridine;2-(3,3-dimethylbutoxy)pyrimidine;2-(3,3-dimethylbutyl)-6-methylpyridine;2-(3,3-dimethylbutyl)pyridine;2-(3,3-dimethylbutyl)pyrimidine;4-(3,3-dimethylbutyl)pyrimidine;2-(2,2-dimethylpropyl)-4,5-dimethyl-1,3-oxazole;bis(3-(2,2-dimethylpropyl)-5-methyl-1,2,4-oxadiazole);bis(5-(2,2-dimethylpropyl)-3-methyl-1,2,4-oxadiazole);2-(2,2-dimethylpropyl)-4-methyl-1,3-oxazole;2-(2,2-dimethylpropyl)-5-methyl-1,3-oxazole;5-(2,2-dimethylpropyl)-2-methyl-1,3-oxazole;bis(5-(2,2-dimethylpropyl)-3-methyl-1,2-oxazole);5-(2,2-dimethylpropyl)-3-phenyl-1,2-oxazole;2-(2,2-dimethylpropyl)pyridine;bis(2-(2,2-dimethylpropyl)pyrimidine)?

The InChIKey is GDNVHDZEDDVJRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O.C14H17NO.C12H19NO.C12H21NO.C12H19N.2C11H17NO.C11H17N.C10H15ClN2O.2C10H16N2O.2C10H16N2.C10H17NO.C10H15N.C9H13ClN2.2C9H14N2.5C9H15NO.4C8H14N2O/c1-14(2,3)10-13-15-12(16-17-13)9-11-7-5-4-6-8-11;1-14(2,3)10-12-9-13(15-16-12)11-7-5-4-6-8-11;1-12(2,3)7-10-8-14-11(13-10)9-5-4-6-9;1-11(2,3)7-10-13-8-9(14-10)12(4,5)6;1-10-6-5-7-11(13-10)8-9-12(2,3)4;1-11(2,3)6-9-7-13-10(12-9)8-4-5-8;1-11(2,3)7-9-13-10-6-4-5-8-12-10;1-11(2,3)8-7-10-6-4-5-9-12-10;1-10(2,3)4-5-14-9-12-6-8(11)7-13-9;1-10(2,3)6-8-11-9(13-12-8)7-4-5-7;1-10(2,3)5-8-13-9-11-6-4-7-12-9;1-10(2,3)6-5-9-11-7-4-8-12-9;1-10(2,3)6-4-9-5-7-11-8-12-9;1-7-8(2)12-9(11-7)6-10(3,4)5;1-10(2,3)8-9-6-4-5-7-11-9;1-9(2,3)4-8-11-5-7(10)6-12-8;2*1-9(2,3)7-8-10-5-4-6-11-8;1-7-10-6-8(11-7)5-9(2,3)4;1-7-6-11-8(10-7)5-9(2,3)4;1-7-6-10-8(11-7)5-9(2,3)4;2*1-7-5-8(11-10-7)6-9(2,3)4;2*1-6-9-7(10-11-6)5-8(2,3)4;2*1-6-9-7(11-10-6)5-8(2,3)4/h4-8H,9-10H2,1-3H3;4-9H,10H2,1-3H3;8-9H,4-7H2,1-3H3;8H,7H2,1-6H3;5-7H,8-9H2,1-4H3;7-8H,4-6H2,1-3H3;4-6,8H,7,9H2,1-3H3;4-6,9H,7-8H2,1-3H3;6-7H,4-5H2,1-3H3;7H,4-6H2,1-3H3;4,6-7H,5,8H2,1-3H3;4,7-8H,5-6H2,1-3H3;5,7-8H,4,6H2,1-3H3;6H2,1-5H3;4-7H,8H2,1-3H3;5-6H,4H2,1-3H3;2*4-6H,7H2,1-3H3;3*6H,5H2,1-4H3;2*5H,6H2,1-4H3;4*5H2,1-4H3.

What are the key properties of 3-benzyl-5-(2,2-dimethylpropyl)-1,2,4-oxadiazole;5-tert-butyl-2-(2,2-dimethylpropyl)-1,3-oxazole;5-chloro-2-(3,3-dimethylbutoxy)pyrimidine;5-chloro-2-(2,2-dimethylpropyl)pyrimidine;2-cyclobutyl-4-(2,2-dimethylpropyl)-1,3-oxazole;5-cyclopropyl-3-(2,2-dimethylpropyl)-1,2,4-oxadiazole;2-cyclopropyl-4-(2,2-dimethylpropyl)-1,3-oxazole;2-(3,3-dimethylbutoxy)pyridine;2-(3,3-dimethylbutoxy)pyrimidine;2-(3,3-dimethylbutyl)-6-methylpyridine;2-(3,3-dimethylbutyl)pyridine;2-(3,3-dimethylbutyl)pyrimidine;4-(3,3-dimethylbutyl)pyrimidine;2-(2,2-dimethylpropyl)-4,5-dimethyl-1,3-oxazole;bis(3-(2,2-dimethylpropyl)-5-methyl-1,2,4-oxadiazole);bis(5-(2,2-dimethylpropyl)-3-methyl-1,2,4-oxadiazole);2-(2,2-dimethylpropyl)-4-methyl-1,3-oxazole;2-(2,2-dimethylpropyl)-5-methyl-1,3-oxazole;5-(2,2-dimethylpropyl)-2-methyl-1,3-oxazole;bis(5-(2,2-dimethylpropyl)-3-methyl-1,2-oxazole);5-(2,2-dimethylpropyl)-3-phenyl-1,2-oxazole;2-(2,2-dimethylpropyl)pyridine;bis(2-(2,2-dimethylpropyl)pyrimidine)?

3-benzyl-5-(2,2-dimethylpropyl)-1,2,4-oxadiazole;5-tert-butyl-2-(2,2-dimethylpropyl)-1,3-oxazole;5-chloro-2-(3,3-dimethylbutoxy)pyrimidine;5-chloro-2-(2,2-dimethylpropyl)pyrimidine;2-cyclobutyl-4-(2,2-dimethylpropyl)-1,3-oxazole;5-cyclopropyl-3-(2,2-dimethylpropyl)-1,2,4-oxadiazole;2-cyclopropyl-4-(2,2-dimethylpropyl)-1,3-oxazole;2-(3,3-dimethylbutoxy)pyridine;2-(3,3-dimethylbutoxy)pyrimidine;2-(3,3-dimethylbutyl)-6-methylpyridine;2-(3,3-dimethylbutyl)pyridine;2-(3,3-dimethylbutyl)pyrimidine;4-(3,3-dimethylbutyl)pyrimidine;2-(2,2-dimethylpropyl)-4,5-dimethyl-1,3-oxazole;bis(3-(2,2-dimethylpropyl)-5-methyl-1,2,4-oxadiazole);bis(5-(2,2-dimethylpropyl)-3-methyl-1,2,4-oxadiazole);2-(2,2-dimethylpropyl)-4-methyl-1,3-oxazole;2-(2,2-dimethylpropyl)-5-methyl-1,3-oxazole;5-(2,2-dimethylpropyl)-2-methyl-1,3-oxazole;bis(5-(2,2-dimethylpropyl)-3-methyl-1,2-oxazole);5-(2,2-dimethylpropyl)-3-phenyl-1,2-oxazole;2-(2,2-dimethylpropyl)pyridine;bis(2-(2,2-dimethylpropyl)pyrimidine) has a molecular weight of 4621.57 g/mol, XLogP of 72.54, 43 rotatable bonds, 0 hydrogen bond donors, and 59 hydrogen bond acceptors.

Where does this data come from?

All data for 3-benzyl-5-(2,2-dimethylpropyl)-1,2,4-oxadiazole;5-tert-butyl-2-(2,2-dimethylpropyl)-1,3-oxazole;5-chloro-2-(3,3-dimethylbutoxy)pyrimidine;5-chloro-2-(2,2-dimethylpropyl)pyrimidine;2-cyclobutyl-4-(2,2-dimethylpropyl)-1,3-oxazole;5-cyclopropyl-3-(2,2-dimethylpropyl)-1,2,4-oxadiazole;2-cyclopropyl-4-(2,2-dimethylpropyl)-1,3-oxazole;2-(3,3-dimethylbutoxy)pyridine;2-(3,3-dimethylbutoxy)pyrimidine;2-(3,3-dimethylbutyl)-6-methylpyridine;2-(3,3-dimethylbutyl)pyridine;2-(3,3-dimethylbutyl)pyrimidine;4-(3,3-dimethylbutyl)pyrimidine;2-(2,2-dimethylpropyl)-4,5-dimethyl-1,3-oxazole;bis(3-(2,2-dimethylpropyl)-5-methyl-1,2,4-oxadiazole);bis(5-(2,2-dimethylpropyl)-3-methyl-1,2,4-oxadiazole);2-(2,2-dimethylpropyl)-4-methyl-1,3-oxazole;2-(2,2-dimethylpropyl)-5-methyl-1,3-oxazole;5-(2,2-dimethylpropyl)-2-methyl-1,3-oxazole;bis(5-(2,2-dimethylpropyl)-3-methyl-1,2-oxazole);5-(2,2-dimethylpropyl)-3-phenyl-1,2-oxazole;2-(2,2-dimethylpropyl)pyridine;bis(2-(2,2-dimethylpropyl)pyrimidine) is sourced from PubChem (CID 158223673), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).