1-decyl-3-ethyl-2-methyl-2H-imidazole

C16H32N2 — CID 69393103

IUPAC1-decyl-3-ethyl-2-methyl-2H-imidazole
SMILESCCCCCCCCCCN1C=CN(CC)C1C
InChIInChI=1S/C16H32N2/c1-4-6-7-8-9-10-11-12-13-18-15-14-17(5-2)16(18)3/h14-16H,4-13H2,1-3H3
InChIKeyACBXAXYBYNHBME-UHFFFAOYSA-N
MW252.45 g/mol
LogP4.58
Rot. Bonds10

About 1-decyl-3-ethyl-2-methyl-2H-imidazole

1-decyl-3-ethyl-2-methyl-2H-imidazole (PubChem CID 69393103) has the molecular formula C16H32N2 and a molecular weight of 252.45 g/mol. Its IUPAC name is 1-decyl-3-ethyl-2-methyl-2H-imidazole.

Molecular Properties

Compound Name1-decyl-3-ethyl-2-methyl-2H-imidazole
PubChem CID69393103
Molecular FormulaC16H32N2
Molecular Weight252.45 g/mol
Exact Mass252.26
IUPAC Name1-decyl-3-ethyl-2-methyl-2H-imidazole
SMILESCCCCCCCCCCN1C=CN(CC)C1C
InChIInChI=1S/C16H32N2/c1-4-6-7-8-9-10-11-12-13-18-15-14-17(5-2)16(18)3/h14-16H,4-13H2,1-3H3
InChIKeyACBXAXYBYNHBME-UHFFFAOYSA-N
XLogP4.58
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.45
LogP ≤ 54.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 1-decyl-3-ethyl-2-methyl-2H-imidazole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-ethyl-3-heptadecyl-2-methyl-2H-imidazole
CID 69396423
1-heptadecyl-2-methyl-3-tridecyl-2H-imidazole
CID 69393888
2-methyl-1,3-dioctyl-2H-imidazole
CID 21393912
2-methyl-1-nonadecyl-3-pentyl-2H-imidazole
CID 69387519
1,3-diheptyl-2-methyl-2H-imidazole
CID 69394446
1,3-didecyl-2-methyl-2H-imidazole
CID 3018046
1-hexyl-2-methyl-3-tetradecyl-2H-imidazole
CID 69392459
1-decyl-2-methyl-3-pentyl-2H-imidazole
CID 69391590
1-decyl-2-methyl-3-tridecyl-2H-imidazole
CID 69388587
1-butyl-2-methyl-3-nonyl-2H-imidazole
CID 69387396
1-butyl-2-methyl-3-tetradecyl-2H-imidazole
CID 69390686
1-dodecyl-2,3-dimethyl-2H-imidazole
CID 68900702

Frequently Asked Questions

What is the IUPAC name of 1-decyl-3-ethyl-2-methyl-2H-imidazole?
The IUPAC name of 1-decyl-3-ethyl-2-methyl-2H-imidazole (CID 69393103) is 1-decyl-3-ethyl-2-methyl-2H-imidazole.
What is the SMILES notation for 1-decyl-3-ethyl-2-methyl-2H-imidazole?
The canonical SMILES for 1-decyl-3-ethyl-2-methyl-2H-imidazole is CCCCCCCCCCN1C=CN(CC)C1C.
What is the InChIKey of 1-decyl-3-ethyl-2-methyl-2H-imidazole?
The InChIKey is ACBXAXYBYNHBME-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2/c1-4-6-7-8-9-10-11-12-13-18-15-14-17(5-2)16(18)3/h14-16H,4-13H2,1-3H3.
What are the key properties of 1-decyl-3-ethyl-2-methyl-2H-imidazole?
1-decyl-3-ethyl-2-methyl-2H-imidazole has a molecular weight of 252.45 g/mol, XLogP of 4.58, 10 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-decyl-3-ethyl-2-methyl-2H-imidazole is sourced from PubChem (CID 69393103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).