1,4-bis(3-methylbutyl)imidazole;2,5-bis(3-methylbutyl)-1,3-oxazole;1,3-bis(3-methylbutyl)pyrazole;1,4-bis(3-methylbutyl)pyrazole;2,5-bis(3-methylbutyl)-1,3-thiazole;1,4-bis(3-methylbutyl)triazole;2,9-dimethyldec-5-ene;1,4-di(propan-2-yl)imidazole;2,5-di(propan-2-yl)-1,3-oxazole;1,3-di(propan-2-yl)pyrazole;1,4-di(propan-2-yl)pyrazole;2,5-di(propan-2-yl)-1,3-thiazole;1,4-di(propan-2-yl)triazole;methane

C155H310N22O2S2 — CID 162268849

About 1,4-bis(3-methylbutyl)imidazole;2,5-bis(3-methylbutyl)-1,3-oxazole;1,3-bis(3-methylbutyl)pyrazole;1,4-bis(3-methylbutyl)pyrazole;2,5-bis(3-methylbutyl)-1,3-thiazole;1,4-bis(3-methylbutyl)triazole;2,9-dimethyldec-5-ene;1,4-di(propan-2-yl)imidazole;2,5-di(propan-2-yl)-1,3-oxazole;1,3-di(propan-2-yl)pyrazole;1,4-di(propan-2-yl)pyrazole;2,5-di(propan-2-yl)-1,3-thiazole;1,4-di(propan-2-yl)triazole;methane

1,4-bis(3-methylbutyl)imidazole;2,5-bis(3-methylbutyl)-1,3-oxazole;1,3-bis(3-methylbutyl)pyrazole;1,4-bis(3-methylbutyl)pyrazole;2,5-bis(3-methylbutyl)-1,3-thiazole;1,4-bis(3-methylbutyl)triazole;2,9-dimethyldec-5-ene;1,4-di(propan-2-yl)imidazole;2,5-di(propan-2-yl)-1,3-oxazole;1,3-di(propan-2-yl)pyrazole;1,4-di(propan-2-yl)pyrazole;2,5-di(propan-2-yl)-1,3-thiazole;1,4-di(propan-2-yl)triazole;methane (PubChem CID 162268849) has the molecular formula C155H310N22O2S2 and a molecular weight of 2578.47 g/mol. Its IUPAC name is 1,4-bis(3-methylbutyl)imidazole;2,5-bis(3-methylbutyl)-1,3-oxazole;1,3-bis(3-methylbutyl)pyrazole;1,4-bis(3-methylbutyl)pyrazole;2,5-bis(3-methylbutyl)-1,3-thiazole;1,4-bis(3-methylbutyl)triazole;2,9-dimethyldec-5-ene;1,4-di(propan-2-yl)imidazole;2,5-di(propan-2-yl)-1,3-oxazole;1,3-di(propan-2-yl)pyrazole;1,4-di(propan-2-yl)pyrazole;2,5-di(propan-2-yl)-1,3-thiazole;1,4-di(propan-2-yl)triazole;methane.

Molecular Properties

• Compound Name: 1,4-bis(3-methylbutyl)imidazole;2,5-bis(3-methylbutyl)-1,3-oxazole;1,3-bis(3-methylbutyl)pyrazole;1,4-bis(3-methylbutyl)pyrazole;2,5-bis(3-methylbutyl)-1,3-thiazole;1,4-bis(3-methylbutyl)triazole;2,9-dimethyldec-5-ene;1,4-di(propan-2-yl)imidazole;2,5-di(propan-2-yl)-1,3-oxazole;1,3-di(propan-2-yl)pyrazole;1,4-di(propan-2-yl)pyrazole;2,5-di(propan-2-yl)-1,3-thiazole;1,4-di(propan-2-yl)triazole;methane
• PubChem CID: 162268849
• Molecular Formula: C155H310N22O2S2
• Molecular Weight: 2578.47 g/mol
• Exact Mass: 2576.43
• IUPAC Name: 1,4-bis(3-methylbutyl)imidazole;2,5-bis(3-methylbutyl)-1,3-oxazole;1,3-bis(3-methylbutyl)pyrazole;1,4-bis(3-methylbutyl)pyrazole;2,5-bis(3-methylbutyl)-1,3-thiazole;1,4-bis(3-methylbutyl)triazole;2,9-dimethyldec-5-ene;1,4-di(propan-2-yl)imidazole;2,5-di(propan-2-yl)-1,3-oxazole;1,3-di(propan-2-yl)pyrazole;1,4-di(propan-2-yl)pyrazole;2,5-di(propan-2-yl)-1,3-thiazole;1,4-di(propan-2-yl)triazole;methane
• SMILES: C.C.C.C.C.C.C.C.C.C.C.C.C.CC(C)CCC=CCCC(C)C.CC(C)CCc1ccn(CCC(C)C)n1.CC(C)CCc1cn(CCC(C)C)cn1.CC(C)CCc1cn(CCC(C)C)nn1.CC(C)CCc1cnc(CCC(C)C)o1.CC(C)CCc1cnc(CCC(C)C)s1.CC(C)CCc1cnn(CCC(C)C)c1.CC(C)c1ccn(C(C)C)n1.CC(C)c1cn(C(C)C)cn1.CC(C)c1cn(C(C)C)nn1.CC(C)c1cnc(C(C)C)o1.CC(C)c1cnc(C(C)C)s1.CC(C)c1cnn(C(C)C)c1
• InChI: InChI=1S/3C13H24N2.C13H23NO.C13H23NS.C12H23N3.C12H24.3C9H16N2.C9H15NO.C9H15NS.C8H15N3.13CH4/c1-11(2)5-6-13-8-10-15(14-13)9-7-12(3)4;1-11(2)5-6-13-9-15(10-14-13)8-7-12(3)4;1-11(2)5-6-13-9-14-15(10-13)8-7-12(3)4;2*1-10(2)5-7-12-9-14-13(15-12)8-6-11(3)4;1-10(2)5-6-12-9-15(14-13-12)8-7-11(3)4;1-11(2)9-7-5-6-8-10-12(3)4;1-7(2)9-5-11(6-10-9)8(3)4;1-7(2)9-5-10-11(6-9)8(3)4;1-7(2)9-5-6-11(10-9)8(3)4;2*1-6(2)8-5-10-9(11-8)7(3)4;1-6(2)8-5-11(7(3)4)10-9-8;;;;;;;;;;;;;/h8,10-12H,5-7,9H2,1-4H3;2*9-12H,5-8H2,1-4H3;3*9-11H,5-8H2,1-4H3;5-6,11-12H,7-10H2,1-4H3;3*5-8H,1-4H3;3*5-7H,1-4H3;13*1H4
• InChIKey: DXWJYFFUKZRWOR-UHFFFAOYSA-N
• XLogP: 50.38
• TPSA: 246.18 Ų
• H-Bond Acceptors: 26
• Rotatable Bonds: 54
• Heavy Atoms: 181
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2578.47
LogP ≤ 5	50.38
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	26

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 1,4-bis(3-methylbutyl)imidazole;2,5-bis(3-methylbutyl)-1,3-oxazole;1,3-bis(3-methylbutyl)pyrazole;1,4-bis(3-methylbutyl)pyrazole;2,5-bis(3-methylbutyl)-1,3-thiazole;1,4-bis(3-methylbutyl)triazole;2,9-dimethyldec-5-ene;1,4-di(propan-2-yl)imidazole;2,5-di(propan-2-yl)-1,3-oxazole;1,3-di(propan-2-yl)pyrazole;1,4-di(propan-2-yl)pyrazole;2,5-di(propan-2-yl)-1,3-thiazole;1,4-di(propan-2-yl)triazole;methane?

The IUPAC name of 1,4-bis(3-methylbutyl)imidazole;2,5-bis(3-methylbutyl)-1,3-oxazole;1,3-bis(3-methylbutyl)pyrazole;1,4-bis(3-methylbutyl)pyrazole;2,5-bis(3-methylbutyl)-1,3-thiazole;1,4-bis(3-methylbutyl)triazole;2,9-dimethyldec-5-ene;1,4-di(propan-2-yl)imidazole;2,5-di(propan-2-yl)-1,3-oxazole;1,3-di(propan-2-yl)pyrazole;1,4-di(propan-2-yl)pyrazole;2,5-di(propan-2-yl)-1,3-thiazole;1,4-di(propan-2-yl)triazole;methane (CID 162268849) is 1,4-bis(3-methylbutyl)imidazole;2,5-bis(3-methylbutyl)-1,3-oxazole;1,3-bis(3-methylbutyl)pyrazole;1,4-bis(3-methylbutyl)pyrazole;2,5-bis(3-methylbutyl)-1,3-thiazole;1,4-bis(3-methylbutyl)triazole;2,9-dimethyldec-5-ene;1,4-di(propan-2-yl)imidazole;2,5-di(propan-2-yl)-1,3-oxazole;1,3-di(propan-2-yl)pyrazole;1,4-di(propan-2-yl)pyrazole;2,5-di(propan-2-yl)-1,3-thiazole;1,4-di(propan-2-yl)triazole;methane.

What is the SMILES notation for 1,4-bis(3-methylbutyl)imidazole;2,5-bis(3-methylbutyl)-1,3-oxazole;1,3-bis(3-methylbutyl)pyrazole;1,4-bis(3-methylbutyl)pyrazole;2,5-bis(3-methylbutyl)-1,3-thiazole;1,4-bis(3-methylbutyl)triazole;2,9-dimethyldec-5-ene;1,4-di(propan-2-yl)imidazole;2,5-di(propan-2-yl)-1,3-oxazole;1,3-di(propan-2-yl)pyrazole;1,4-di(propan-2-yl)pyrazole;2,5-di(propan-2-yl)-1,3-thiazole;1,4-di(propan-2-yl)triazole;methane?

The canonical SMILES for 1,4-bis(3-methylbutyl)imidazole;2,5-bis(3-methylbutyl)-1,3-oxazole;1,3-bis(3-methylbutyl)pyrazole;1,4-bis(3-methylbutyl)pyrazole;2,5-bis(3-methylbutyl)-1,3-thiazole;1,4-bis(3-methylbutyl)triazole;2,9-dimethyldec-5-ene;1,4-di(propan-2-yl)imidazole;2,5-di(propan-2-yl)-1,3-oxazole;1,3-di(propan-2-yl)pyrazole;1,4-di(propan-2-yl)pyrazole;2,5-di(propan-2-yl)-1,3-thiazole;1,4-di(propan-2-yl)triazole;methane is C.C.C.C.C.C.C.C.C.C.C.C.C.CC(C)CCC=CCCC(C)C.CC(C)CCc1ccn(CCC(C)C)n1.CC(C)CCc1cn(CCC(C)C)cn1.CC(C)CCc1cn(CCC(C)C)nn1.CC(C)CCc1cnc(CCC(C)C)o1.CC(C)CCc1cnc(CCC(C)C)s1.CC(C)CCc1cnn(CCC(C)C)c1.CC(C)c1ccn(C(C)C)n1.CC(C)c1cn(C(C)C)cn1.CC(C)c1cn(C(C)C)nn1.CC(C)c1cnc(C(C)C)o1.CC(C)c1cnc(C(C)C)s1.CC(C)c1cnn(C(C)C)c1.

What is the InChIKey of 1,4-bis(3-methylbutyl)imidazole;2,5-bis(3-methylbutyl)-1,3-oxazole;1,3-bis(3-methylbutyl)pyrazole;1,4-bis(3-methylbutyl)pyrazole;2,5-bis(3-methylbutyl)-1,3-thiazole;1,4-bis(3-methylbutyl)triazole;2,9-dimethyldec-5-ene;1,4-di(propan-2-yl)imidazole;2,5-di(propan-2-yl)-1,3-oxazole;1,3-di(propan-2-yl)pyrazole;1,4-di(propan-2-yl)pyrazole;2,5-di(propan-2-yl)-1,3-thiazole;1,4-di(propan-2-yl)triazole;methane?

The InChIKey is DXWJYFFUKZRWOR-UHFFFAOYSA-N. The full InChI is InChI=1S/3C13H24N2.C13H23NO.C13H23NS.C12H23N3.C12H24.3C9H16N2.C9H15NO.C9H15NS.C8H15N3.13CH4/c1-11(2)5-6-13-8-10-15(14-13)9-7-12(3)4;1-11(2)5-6-13-9-15(10-14-13)8-7-12(3)4;1-11(2)5-6-13-9-14-15(10-13)8-7-12(3)4;2*1-10(2)5-7-12-9-14-13(15-12)8-6-11(3)4;1-10(2)5-6-12-9-15(14-13-12)8-7-11(3)4;1-11(2)9-7-5-6-8-10-12(3)4;1-7(2)9-5-11(6-10-9)8(3)4;1-7(2)9-5-10-11(6-9)8(3)4;1-7(2)9-5-6-11(10-9)8(3)4;2*1-6(2)8-5-10-9(11-8)7(3)4;1-6(2)8-5-11(7(3)4)10-9-8;;;;;;;;;;;;;/h8,10-12H,5-7,9H2,1-4H3;2*9-12H,5-8H2,1-4H3;3*9-11H,5-8H2,1-4H3;5-6,11-12H,7-10H2,1-4H3;3*5-8H,1-4H3;3*5-7H,1-4H3;13*1H4.

What are the key properties of 1,4-bis(3-methylbutyl)imidazole;2,5-bis(3-methylbutyl)-1,3-oxazole;1,3-bis(3-methylbutyl)pyrazole;1,4-bis(3-methylbutyl)pyrazole;2,5-bis(3-methylbutyl)-1,3-thiazole;1,4-bis(3-methylbutyl)triazole;2,9-dimethyldec-5-ene;1,4-di(propan-2-yl)imidazole;2,5-di(propan-2-yl)-1,3-oxazole;1,3-di(propan-2-yl)pyrazole;1,4-di(propan-2-yl)pyrazole;2,5-di(propan-2-yl)-1,3-thiazole;1,4-di(propan-2-yl)triazole;methane?

1,4-bis(3-methylbutyl)imidazole;2,5-bis(3-methylbutyl)-1,3-oxazole;1,3-bis(3-methylbutyl)pyrazole;1,4-bis(3-methylbutyl)pyrazole;2,5-bis(3-methylbutyl)-1,3-thiazole;1,4-bis(3-methylbutyl)triazole;2,9-dimethyldec-5-ene;1,4-di(propan-2-yl)imidazole;2,5-di(propan-2-yl)-1,3-oxazole;1,3-di(propan-2-yl)pyrazole;1,4-di(propan-2-yl)pyrazole;2,5-di(propan-2-yl)-1,3-thiazole;1,4-di(propan-2-yl)triazole;methane has a molecular weight of 2578.47 g/mol, XLogP of 50.38, 54 rotatable bonds, 0 hydrogen bond donors, and 26 hydrogen bond acceptors.

Where does this data come from?

All data for 1,4-bis(3-methylbutyl)imidazole;2,5-bis(3-methylbutyl)-1,3-oxazole;1,3-bis(3-methylbutyl)pyrazole;1,4-bis(3-methylbutyl)pyrazole;2,5-bis(3-methylbutyl)-1,3-thiazole;1,4-bis(3-methylbutyl)triazole;2,9-dimethyldec-5-ene;1,4-di(propan-2-yl)imidazole;2,5-di(propan-2-yl)-1,3-oxazole;1,3-di(propan-2-yl)pyrazole;1,4-di(propan-2-yl)pyrazole;2,5-di(propan-2-yl)-1,3-thiazole;1,4-di(propan-2-yl)triazole;methane is sourced from PubChem (CID 162268849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).