5-cyclobutyl-1-propan-2-ylimidazole;4-cyclobutyl-3-propan-2-yl-1,2-oxazole;5-cyclohexyl-1-propan-2-ylimidazole;4-cyclohexyl-3-propan-2-yl-1,2-oxazole;5-cyclopentyl-1-propan-2-ylimidazole;4-cyclopentyl-3-propan-2-yl-1,2-oxazole;5-cyclopropyl-1-propan-2-ylimidazole;4-cyclopropyl-3-propan-2-yl-1,2-oxazole;1,5-di(propan-2-yl)imidazole;3,4-di(propan-2-yl)-1,2-oxazole;4-ethyl-3-propan-2-yl-1,2-oxazole;4-methyl-3-propan-2-yl-1,2-oxazole;tetrakis(1-propan-2-yl-5-propylimidazole);tetrakis(3-propan-2-yl-4-propyl-1,2-oxazole)

C189H311N29O11 — CID 158267493

IUPAC5-cyclobutyl-1-propan-2-ylimidazole;4-cyclobutyl-3-propan-2-yl-1,2-oxazole;5-cyclohexyl-1-propan-2-ylimidazole;4-cyclohexyl-3-propan-2-yl-1,2-oxazole;5-cyclopentyl-1-propan-2-ylimidazole;4-cyclopentyl-3-propan-2-yl-1,2-oxazole;5-cyclopropyl-1-propan-2-ylimidazole;4-cyclopropyl-3-propan-2-yl-1,2-oxazole;1,5-di(propan-2-yl)imidazole;3,4-di(propan-2-yl)-1,2-oxazole;4-ethyl-3-propan-2-yl-1,2-oxazole;4-methyl-3-propan-2-yl-1,2-oxazole;tetrakis(1-propan-2-yl-5-propylimidazole);tetrakis(3-propan-2-yl-4-propyl-1,2-oxazole)
SMILESCC(C)c1cncn1C(C)C.CC(C)c1conc1C(C)C.CC(C)c1nocc1C1CC1.CC(C)c1nocc1C1CCC1.CC(C)c1nocc1C1CCCC1.CC(C)c1nocc1C1CCCCC1.CC(C)n1cncc1C1CC1.CC(C)n1cncc1C1CCC1.CC(C)n1cncc1C1CCCC1.CC(C)n1cncc1C1CCCCC1.CCCc1cncn1C(C)C.CCCc1cncn1C(C)C.CCCc1cncn1C(C)C.CCCc1cncn1C(C)C.CCCc1conc1C(C)C.CCCc1conc1C(C)C.CCCc1conc1C(C)C.CCCc1conc1C(C)C.CCc1conc1C(C)C.Cc1conc1C(C)C
InChIInChI=1S/C12H20N2.C12H19NO.C11H18N2.C11H17NO.C10H16N2.C10H15NO.C9H14N2.5C9H16N2.C9H13NO.5C9H15NO.C8H13NO.C7H11NO/c1-10(2)14-9-13-8-12(14)11-6-4-3-5-7-11;1-9(2)12-11(8-14-13-12)10-6-4-3-5-7-10;1-9(2)13-8-12-7-11(13)10-5-3-4-6-10;1-8(2)11-10(7-13-12-11)9-5-3-4-6-9;1-8(2)12-7-11-6-10(12)9-4-3-5-9;1-7(2)10-9(6-12-11-10)8-4-3-5-8;1-7(2)11-6-10-5-9(11)8-3-4-8;1-7(2)9-5-10-6-11(9)8(3)4;4*1-4-5-9-6-10-7-11(9)8(2)3;1-6(2)9-8(5-11-10-9)7-3-4-7;1-6(2)8-5-11-10-9(8)7(3)4;4*1-4-5-8-6-11-10-9(8)7(2)3;1-4-7-5-10-9-8(7)6(2)3;1-5(2)7-6(3)4-9-8-7/h8-11H,3-7H2,1-2H3;8-10H,3-7H2,1-2H3;7-10H,3-6H2,1-2H3;7-9H,3-6H2,1-2H3;6-9H,3-5H2,1-2H3;6-8H,3-5H2,1-2H3;5-8H,3-4H2,1-2H3;5-8H,1-4H3;4*6-8H,4-5H2,1-3H3;5-7H,3-4H2,1-2H3;5-7H,1-4H3;4*6-7H,4-5H2,1-3H3;5-6H,4H2,1-3H3;4-5H,1-3H3
InChIKeyGIPZGFBWDJOXGQ-UHFFFAOYSA-N
MW3165.76 g/mol
LogP55.39
Rot. Bonds47

About 5-cyclobutyl-1-propan-2-ylimidazole;4-cyclobutyl-3-propan-2-yl-1,2-oxazole;5-cyclohexyl-1-propan-2-ylimidazole;4-cyclohexyl-3-propan-2-yl-1,2-oxazole;5-cyclopentyl-1-propan-2-ylimidazole;4-cyclopentyl-3-propan-2-yl-1,2-oxazole;5-cyclopropyl-1-propan-2-ylimidazole;4-cyclopropyl-3-propan-2-yl-1,2-oxazole;1,5-di(propan-2-yl)imidazole;3,4-di(propan-2-yl)-1,2-oxazole;4-ethyl-3-propan-2-yl-1,2-oxazole;4-methyl-3-propan-2-yl-1,2-oxazole;tetrakis(1-propan-2-yl-5-propylimidazole);tetrakis(3-propan-2-yl-4-propyl-1,2-oxazole)

5-cyclobutyl-1-propan-2-ylimidazole;4-cyclobutyl-3-propan-2-yl-1,2-oxazole;5-cyclohexyl-1-propan-2-ylimidazole;4-cyclohexyl-3-propan-2-yl-1,2-oxazole;5-cyclopentyl-1-propan-2-ylimidazole;4-cyclopentyl-3-propan-2-yl-1,2-oxazole;5-cyclopropyl-1-propan-2-ylimidazole;4-cyclopropyl-3-propan-2-yl-1,2-oxazole;1,5-di(propan-2-yl)imidazole;3,4-di(propan-2-yl)-1,2-oxazole;4-ethyl-3-propan-2-yl-1,2-oxazole;4-methyl-3-propan-2-yl-1,2-oxazole;tetrakis(1-propan-2-yl-5-propylimidazole);tetrakis(3-propan-2-yl-4-propyl-1,2-oxazole) (PubChem CID 158267493) has the molecular formula C189H311N29O11 and a molecular weight of 3165.76 g/mol. Its IUPAC name is 5-cyclobutyl-1-propan-2-ylimidazole;4-cyclobutyl-3-propan-2-yl-1,2-oxazole;5-cyclohexyl-1-propan-2-ylimidazole;4-cyclohexyl-3-propan-2-yl-1,2-oxazole;5-cyclopentyl-1-propan-2-ylimidazole;4-cyclopentyl-3-propan-2-yl-1,2-oxazole;5-cyclopropyl-1-propan-2-ylimidazole;4-cyclopropyl-3-propan-2-yl-1,2-oxazole;1,5-di(propan-2-yl)imidazole;3,4-di(propan-2-yl)-1,2-oxazole;4-ethyl-3-propan-2-yl-1,2-oxazole;4-methyl-3-propan-2-yl-1,2-oxazole;tetrakis(1-propan-2-yl-5-propylimidazole);tetrakis(3-propan-2-yl-4-propyl-1,2-oxazole).

Molecular Properties

Compound Name5-cyclobutyl-1-propan-2-ylimidazole;4-cyclobutyl-3-propan-2-yl-1,2-oxazole;5-cyclohexyl-1-propan-2-ylimidazole;4-cyclohexyl-3-propan-2-yl-1,2-oxazole;5-cyclopentyl-1-propan-2-ylimidazole;4-cyclopentyl-3-propan-2-yl-1,2-oxazole;5-cyclopropyl-1-propan-2-ylimidazole;4-cyclopropyl-3-propan-2-yl-1,2-oxazole;1,5-di(propan-2-yl)imidazole;3,4-di(propan-2-yl)-1,2-oxazole;4-ethyl-3-propan-2-yl-1,2-oxazole;4-methyl-3-propan-2-yl-1,2-oxazole;tetrakis(1-propan-2-yl-5-propylimidazole);tetrakis(3-propan-2-yl-4-propyl-1,2-oxazole)
PubChem CID158267493
Molecular FormulaC189H311N29O11
Molecular Weight3165.76 g/mol
Exact Mass3163.47
IUPAC Name5-cyclobutyl-1-propan-2-ylimidazole;4-cyclobutyl-3-propan-2-yl-1,2-oxazole;5-cyclohexyl-1-propan-2-ylimidazole;4-cyclohexyl-3-propan-2-yl-1,2-oxazole;5-cyclopentyl-1-propan-2-ylimidazole;4-cyclopentyl-3-propan-2-yl-1,2-oxazole;5-cyclopropyl-1-propan-2-ylimidazole;4-cyclopropyl-3-propan-2-yl-1,2-oxazole;1,5-di(propan-2-yl)imidazole;3,4-di(propan-2-yl)-1,2-oxazole;4-ethyl-3-propan-2-yl-1,2-oxazole;4-methyl-3-propan-2-yl-1,2-oxazole;tetrakis(1-propan-2-yl-5-propylimidazole);tetrakis(3-propan-2-yl-4-propyl-1,2-oxazole)
SMILESCC(C)c1cncn1C(C)C.CC(C)c1conc1C(C)C.CC(C)c1nocc1C1CC1.CC(C)c1nocc1C1CCC1.CC(C)c1nocc1C1CCCC1.CC(C)c1nocc1C1CCCCC1.CC(C)n1cncc1C1CC1.CC(C)n1cncc1C1CCC1.CC(C)n1cncc1C1CCCC1.CC(C)n1cncc1C1CCCCC1.CCCc1cncn1C(C)C.CCCc1cncn1C(C)C.CCCc1cncn1C(C)C.CCCc1cncn1C(C)C.CCCc1conc1C(C)C.CCCc1conc1C(C)C.CCCc1conc1C(C)C.CCCc1conc1C(C)C.CCc1conc1C(C)C.Cc1conc1C(C)C
InChIInChI=1S/C12H20N2.C12H19NO.C11H18N2.C11H17NO.C10H16N2.C10H15NO.C9H14N2.5C9H16N2.C9H13NO.5C9H15NO.C8H13NO.C7H11NO/c1-10(2)14-9-13-8-12(14)11-6-4-3-5-7-11;1-9(2)12-11(8-14-13-12)10-6-4-3-5-7-10;1-9(2)13-8-12-7-11(13)10-5-3-4-6-10;1-8(2)11-10(7-13-12-11)9-5-3-4-6-9;1-8(2)12-7-11-6-10(12)9-4-3-5-9;1-7(2)10-9(6-12-11-10)8-4-3-5-8;1-7(2)11-6-10-5-9(11)8-3-4-8;1-7(2)9-5-10-6-11(9)8(3)4;4*1-4-5-9-6-10-7-11(9)8(2)3;1-6(2)9-8(5-11-10-9)7-3-4-7;1-6(2)8-5-11-10-9(8)7(3)4;4*1-4-5-8-6-11-10-9(8)7(2)3;1-4-7-5-10-9-8(7)6(2)3;1-5(2)7-6(3)4-9-8-7/h8-11H,3-7H2,1-2H3;8-10H,3-7H2,1-2H3;7-10H,3-6H2,1-2H3;7-9H,3-6H2,1-2H3;6-9H,3-5H2,1-2H3;6-8H,3-5H2,1-2H3;5-8H,3-4H2,1-2H3;5-8H,1-4H3;4*6-8H,4-5H2,1-3H3;5-7H,3-4H2,1-2H3;5-7H,1-4H3;4*6-7H,4-5H2,1-3H3;5-6H,4H2,1-3H3;4-5H,1-3H3
InChIKeyGIPZGFBWDJOXGQ-UHFFFAOYSA-N
XLogP55.39
TPSA446.71 Ų
H-Bond Donors
H-Bond Acceptors40
Rotatable Bonds47
Heavy Atoms229
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003165.76
LogP ≤ 555.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1040

Analyze 5-cyclobutyl-1-propan-2-ylimidazole;4-cyclobutyl-3-propan-2-yl-1,2-oxazole;5-cyclohexyl-1-propan-2-ylimidazole;4-cyclohexyl-3-propan-2-yl-1,2-oxazole;5-cyclopentyl-1-propan-2-ylimidazole;4-cyclopentyl-3-propan-2-yl-1,2-oxazole;5-cyclopropyl-1-propan-2-ylimidazole;4-cyclopropyl-3-propan-2-yl-1,2-oxazole;1,5-di(propan-2-yl)imidazole;3,4-di(propan-2-yl)-1,2-oxazole;4-ethyl-3-propan-2-yl-1,2-oxazole;4-methyl-3-propan-2-yl-1,2-oxazole;tetrakis(1-propan-2-yl-5-propylimidazole);tetrakis(3-propan-2-yl-4-propyl-1,2-oxazole) with MolForge

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Frequently Asked Questions

What is the IUPAC name of 5-cyclobutyl-1-propan-2-ylimidazole;4-cyclobutyl-3-propan-2-yl-1,2-oxazole;5-cyclohexyl-1-propan-2-ylimidazole;4-cyclohexyl-3-propan-2-yl-1,2-oxazole;5-cyclopentyl-1-propan-2-ylimidazole;4-cyclopentyl-3-propan-2-yl-1,2-oxazole;5-cyclopropyl-1-propan-2-ylimidazole;4-cyclopropyl-3-propan-2-yl-1,2-oxazole;1,5-di(propan-2-yl)imidazole;3,4-di(propan-2-yl)-1,2-oxazole;4-ethyl-3-propan-2-yl-1,2-oxazole;4-methyl-3-propan-2-yl-1,2-oxazole;tetrakis(1-propan-2-yl-5-propylimidazole);tetrakis(3-propan-2-yl-4-propyl-1,2-oxazole)?
The IUPAC name of 5-cyclobutyl-1-propan-2-ylimidazole;4-cyclobutyl-3-propan-2-yl-1,2-oxazole;5-cyclohexyl-1-propan-2-ylimidazole;4-cyclohexyl-3-propan-2-yl-1,2-oxazole;5-cyclopentyl-1-propan-2-ylimidazole;4-cyclopentyl-3-propan-2-yl-1,2-oxazole;5-cyclopropyl-1-propan-2-ylimidazole;4-cyclopropyl-3-propan-2-yl-1,2-oxazole;1,5-di(propan-2-yl)imidazole;3,4-di(propan-2-yl)-1,2-oxazole;4-ethyl-3-propan-2-yl-1,2-oxazole;4-methyl-3-propan-2-yl-1,2-oxazole;tetrakis(1-propan-2-yl-5-propylimidazole);tetrakis(3-propan-2-yl-4-propyl-1,2-oxazole) (CID 158267493) is 5-cyclobutyl-1-propan-2-ylimidazole;4-cyclobutyl-3-propan-2-yl-1,2-oxazole;5-cyclohexyl-1-propan-2-ylimidazole;4-cyclohexyl-3-propan-2-yl-1,2-oxazole;5-cyclopentyl-1-propan-2-ylimidazole;4-cyclopentyl-3-propan-2-yl-1,2-oxazole;5-cyclopropyl-1-propan-2-ylimidazole;4-cyclopropyl-3-propan-2-yl-1,2-oxazole;1,5-di(propan-2-yl)imidazole;3,4-di(propan-2-yl)-1,2-oxazole;4-ethyl-3-propan-2-yl-1,2-oxazole;4-methyl-3-propan-2-yl-1,2-oxazole;tetrakis(1-propan-2-yl-5-propylimidazole);tetrakis(3-propan-2-yl-4-propyl-1,2-oxazole).
What is the SMILES notation for 5-cyclobutyl-1-propan-2-ylimidazole;4-cyclobutyl-3-propan-2-yl-1,2-oxazole;5-cyclohexyl-1-propan-2-ylimidazole;4-cyclohexyl-3-propan-2-yl-1,2-oxazole;5-cyclopentyl-1-propan-2-ylimidazole;4-cyclopentyl-3-propan-2-yl-1,2-oxazole;5-cyclopropyl-1-propan-2-ylimidazole;4-cyclopropyl-3-propan-2-yl-1,2-oxazole;1,5-di(propan-2-yl)imidazole;3,4-di(propan-2-yl)-1,2-oxazole;4-ethyl-3-propan-2-yl-1,2-oxazole;4-methyl-3-propan-2-yl-1,2-oxazole;tetrakis(1-propan-2-yl-5-propylimidazole);tetrakis(3-propan-2-yl-4-propyl-1,2-oxazole)?
The canonical SMILES for 5-cyclobutyl-1-propan-2-ylimidazole;4-cyclobutyl-3-propan-2-yl-1,2-oxazole;5-cyclohexyl-1-propan-2-ylimidazole;4-cyclohexyl-3-propan-2-yl-1,2-oxazole;5-cyclopentyl-1-propan-2-ylimidazole;4-cyclopentyl-3-propan-2-yl-1,2-oxazole;5-cyclopropyl-1-propan-2-ylimidazole;4-cyclopropyl-3-propan-2-yl-1,2-oxazole;1,5-di(propan-2-yl)imidazole;3,4-di(propan-2-yl)-1,2-oxazole;4-ethyl-3-propan-2-yl-1,2-oxazole;4-methyl-3-propan-2-yl-1,2-oxazole;tetrakis(1-propan-2-yl-5-propylimidazole);tetrakis(3-propan-2-yl-4-propyl-1,2-oxazole) is CC(C)c1cncn1C(C)C.CC(C)c1conc1C(C)C.CC(C)c1nocc1C1CC1.CC(C)c1nocc1C1CCC1.CC(C)c1nocc1C1CCCC1.CC(C)c1nocc1C1CCCCC1.CC(C)n1cncc1C1CC1.CC(C)n1cncc1C1CCC1.CC(C)n1cncc1C1CCCC1.CC(C)n1cncc1C1CCCCC1.CCCc1cncn1C(C)C.CCCc1cncn1C(C)C.CCCc1cncn1C(C)C.CCCc1cncn1C(C)C.CCCc1conc1C(C)C.CCCc1conc1C(C)C.CCCc1conc1C(C)C.CCCc1conc1C(C)C.CCc1conc1C(C)C.Cc1conc1C(C)C.
What is the InChIKey of 5-cyclobutyl-1-propan-2-ylimidazole;4-cyclobutyl-3-propan-2-yl-1,2-oxazole;5-cyclohexyl-1-propan-2-ylimidazole;4-cyclohexyl-3-propan-2-yl-1,2-oxazole;5-cyclopentyl-1-propan-2-ylimidazole;4-cyclopentyl-3-propan-2-yl-1,2-oxazole;5-cyclopropyl-1-propan-2-ylimidazole;4-cyclopropyl-3-propan-2-yl-1,2-oxazole;1,5-di(propan-2-yl)imidazole;3,4-di(propan-2-yl)-1,2-oxazole;4-ethyl-3-propan-2-yl-1,2-oxazole;4-methyl-3-propan-2-yl-1,2-oxazole;tetrakis(1-propan-2-yl-5-propylimidazole);tetrakis(3-propan-2-yl-4-propyl-1,2-oxazole)?
The InChIKey is GIPZGFBWDJOXGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2.C12H19NO.C11H18N2.C11H17NO.C10H16N2.C10H15NO.C9H14N2.5C9H16N2.C9H13NO.5C9H15NO.C8H13NO.C7H11NO/c1-10(2)14-9-13-8-12(14)11-6-4-3-5-7-11;1-9(2)12-11(8-14-13-12)10-6-4-3-5-7-10;1-9(2)13-8-12-7-11(13)10-5-3-4-6-10;1-8(2)11-10(7-13-12-11)9-5-3-4-6-9;1-8(2)12-7-11-6-10(12)9-4-3-5-9;1-7(2)10-9(6-12-11-10)8-4-3-5-8;1-7(2)11-6-10-5-9(11)8-3-4-8;1-7(2)9-5-10-6-11(9)8(3)4;4*1-4-5-9-6-10-7-11(9)8(2)3;1-6(2)9-8(5-11-10-9)7-3-4-7;1-6(2)8-5-11-10-9(8)7(3)4;4*1-4-5-8-6-11-10-9(8)7(2)3;1-4-7-5-10-9-8(7)6(2)3;1-5(2)7-6(3)4-9-8-7/h8-11H,3-7H2,1-2H3;8-10H,3-7H2,1-2H3;7-10H,3-6H2,1-2H3;7-9H,3-6H2,1-2H3;6-9H,3-5H2,1-2H3;6-8H,3-5H2,1-2H3;5-8H,3-4H2,1-2H3;5-8H,1-4H3;4*6-8H,4-5H2,1-3H3;5-7H,3-4H2,1-2H3;5-7H,1-4H3;4*6-7H,4-5H2,1-3H3;5-6H,4H2,1-3H3;4-5H,1-3H3.
What are the key properties of 5-cyclobutyl-1-propan-2-ylimidazole;4-cyclobutyl-3-propan-2-yl-1,2-oxazole;5-cyclohexyl-1-propan-2-ylimidazole;4-cyclohexyl-3-propan-2-yl-1,2-oxazole;5-cyclopentyl-1-propan-2-ylimidazole;4-cyclopentyl-3-propan-2-yl-1,2-oxazole;5-cyclopropyl-1-propan-2-ylimidazole;4-cyclopropyl-3-propan-2-yl-1,2-oxazole;1,5-di(propan-2-yl)imidazole;3,4-di(propan-2-yl)-1,2-oxazole;4-ethyl-3-propan-2-yl-1,2-oxazole;4-methyl-3-propan-2-yl-1,2-oxazole;tetrakis(1-propan-2-yl-5-propylimidazole);tetrakis(3-propan-2-yl-4-propyl-1,2-oxazole)?
5-cyclobutyl-1-propan-2-ylimidazole;4-cyclobutyl-3-propan-2-yl-1,2-oxazole;5-cyclohexyl-1-propan-2-ylimidazole;4-cyclohexyl-3-propan-2-yl-1,2-oxazole;5-cyclopentyl-1-propan-2-ylimidazole;4-cyclopentyl-3-propan-2-yl-1,2-oxazole;5-cyclopropyl-1-propan-2-ylimidazole;4-cyclopropyl-3-propan-2-yl-1,2-oxazole;1,5-di(propan-2-yl)imidazole;3,4-di(propan-2-yl)-1,2-oxazole;4-ethyl-3-propan-2-yl-1,2-oxazole;4-methyl-3-propan-2-yl-1,2-oxazole;tetrakis(1-propan-2-yl-5-propylimidazole);tetrakis(3-propan-2-yl-4-propyl-1,2-oxazole) has a molecular weight of 3165.76 g/mol, XLogP of 55.39, 47 rotatable bonds, 0 hydrogen bond donors, and 40 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclobutyl-1-propan-2-ylimidazole;4-cyclobutyl-3-propan-2-yl-1,2-oxazole;5-cyclohexyl-1-propan-2-ylimidazole;4-cyclohexyl-3-propan-2-yl-1,2-oxazole;5-cyclopentyl-1-propan-2-ylimidazole;4-cyclopentyl-3-propan-2-yl-1,2-oxazole;5-cyclopropyl-1-propan-2-ylimidazole;4-cyclopropyl-3-propan-2-yl-1,2-oxazole;1,5-di(propan-2-yl)imidazole;3,4-di(propan-2-yl)-1,2-oxazole;4-ethyl-3-propan-2-yl-1,2-oxazole;4-methyl-3-propan-2-yl-1,2-oxazole;tetrakis(1-propan-2-yl-5-propylimidazole);tetrakis(3-propan-2-yl-4-propyl-1,2-oxazole) is sourced from PubChem (CID 158267493), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).