2,4-didecyl-1-methylimidazole

C24H46N2 — CID 68813551

IUPAC2,4-didecyl-1-methylimidazole
SMILESCCCCCCCCCCc1cn(C)c(CCCCCCCCCC)n1
InChIInChI=1S/C24H46N2/c1-4-6-8-10-12-14-16-18-20-23-22-26(3)24(25-23)21-19-17-15-13-11-9-7-5-2/h22H,4-21H2,1-3H3
InChIKeyJIDUQLCZVVUELW-UHFFFAOYSA-N
MW362.65 g/mol
LogP7.79
Rot. Bonds18

About 2,4-didecyl-1-methylimidazole

2,4-didecyl-1-methylimidazole (PubChem CID 68813551) has the molecular formula C24H46N2 and a molecular weight of 362.65 g/mol. Its IUPAC name is 2,4-didecyl-1-methylimidazole.

Molecular Properties

Compound Name2,4-didecyl-1-methylimidazole
PubChem CID68813551
Molecular FormulaC24H46N2
Molecular Weight362.65 g/mol
Exact Mass362.37
IUPAC Name2,4-didecyl-1-methylimidazole
SMILESCCCCCCCCCCc1cn(C)c(CCCCCCCCCC)n1
InChIInChI=1S/C24H46N2/c1-4-6-8-10-12-14-16-18-20-23-22-26(3)24(25-23)21-19-17-15-13-11-9-7-5-2/h22H,4-21H2,1-3H3
InChIKeyJIDUQLCZVVUELW-UHFFFAOYSA-N
XLogP7.79
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds18
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500362.65
LogP ≤ 57.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-heptyl-1-methyl-4-(3-phenylpropyl)imidazole
CID 69392771
2-decyl-1-methyl-4-(3-phenylpropyl)imidazole
CID 69396106
1,2-dimethyl-4-octylimidazole
CID 118062821
2-(1-methyl-2-propylimidazol-4-yl)ethanamine
CID 82279407
2-dodecyl-1-heptadecyl-4-(3-phenylpropyl)imidazole
CID 69389170
1-pentyl-4-(3-phenylpropyl)-2-tridecylimidazole
CID 69394705
1-hexadecyl-4-(3-phenylpropyl)-2-tridecylimidazole
CID 69394149
1-octyl-4-(3-phenylpropyl)-2-undecylimidazole
CID 69393954
1-decyl-2-hexyl-4-(3-phenylpropyl)imidazole
CID 69395730
1-butyl-4-(3-phenylpropyl)-2-tetradecylimidazole
CID 69393201
2-hexyl-1-pentadecyl-4-(3-phenylpropyl)imidazole
CID 69388588
1-pentadecyl-4-(3-phenylpropyl)-2-tridecylimidazole
CID 69391173

Frequently Asked Questions

What is the IUPAC name of 2,4-didecyl-1-methylimidazole?
The IUPAC name of 2,4-didecyl-1-methylimidazole (CID 68813551) is 2,4-didecyl-1-methylimidazole.
What is the SMILES notation for 2,4-didecyl-1-methylimidazole?
The canonical SMILES for 2,4-didecyl-1-methylimidazole is CCCCCCCCCCc1cn(C)c(CCCCCCCCCC)n1.
What is the InChIKey of 2,4-didecyl-1-methylimidazole?
The InChIKey is JIDUQLCZVVUELW-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H46N2/c1-4-6-8-10-12-14-16-18-20-23-22-26(3)24(25-23)21-19-17-15-13-11-9-7-5-2/h22H,4-21H2,1-3H3.
What are the key properties of 2,4-didecyl-1-methylimidazole?
2,4-didecyl-1-methylimidazole has a molecular weight of 362.65 g/mol, XLogP of 7.79, 18 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-didecyl-1-methylimidazole is sourced from PubChem (CID 68813551), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).