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

C15H30N2 — CID 19864130

IUPAC1-decyl-3-ethyl-2H-imidazole
SMILESCCCCCCCCCCN1C=CN(CC)C1
InChIInChI=1S/C15H30N2/c1-3-5-6-7-8-9-10-11-12-17-14-13-16(4-2)15-17/h13-14H,3-12,15H2,1-2H3
InChIKeyMKNCYIGQGNKLJU-UHFFFAOYSA-N
MW238.42 g/mol
LogP4.19
Rot. Bonds10

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

1-decyl-3-ethyl-2H-imidazole (PubChem CID 19864130) has the molecular formula C15H30N2 and a molecular weight of 238.42 g/mol. Its IUPAC name is 1-decyl-3-ethyl-2H-imidazole.

Molecular Properties

Compound Name1-decyl-3-ethyl-2H-imidazole
PubChem CID19864130
Molecular FormulaC15H30N2
Molecular Weight238.42 g/mol
Exact Mass238.24
IUPAC Name1-decyl-3-ethyl-2H-imidazole
SMILESCCCCCCCCCCN1C=CN(CC)C1
InChIInChI=1S/C15H30N2/c1-3-5-6-7-8-9-10-11-12-17-14-13-16(4-2)15-17/h13-14H,3-12,15H2,1-2H3
InChIKeyMKNCYIGQGNKLJU-UHFFFAOYSA-N
XLogP4.19
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.42
LogP ≤ 54.19
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

1-ethyl-3-hexyl-2H-imidazole;hydrobromide
CID 173078365
1-ethyl-3-octyl-2H-imidazole;hydroiodide
CID 173446352
1-heptyl-3-nonyl-2H-imidazole
CID 69393199
1-nonyl-3-undecyl-2H-imidazole
CID 69391482
1-dodecyl-3-octadecyl-2H-imidazole
CID 68899578
1-pentadecyl-3-tridecyl-2H-imidazole
CID 69396629
1-hexadecyl-3-octadecyl-2H-imidazole
CID 68970156
1-octyl-3-undecyl-2H-imidazole
CID 69389433
1-hexyl-3-nonadecyl-2H-imidazole
CID 69396204
1,3-di(nonyl)-2H-imidazole
CID 69395396
1-hexyl-3-octadecyl-2H-imidazole
CID 68966514
1-butyl-3-ethyl-2H-imidazole;hydroiodide
CID 173049590

Frequently Asked Questions

What is the IUPAC name of 1-decyl-3-ethyl-2H-imidazole?
The IUPAC name of 1-decyl-3-ethyl-2H-imidazole (CID 19864130) is 1-decyl-3-ethyl-2H-imidazole.
What is the SMILES notation for 1-decyl-3-ethyl-2H-imidazole?
The canonical SMILES for 1-decyl-3-ethyl-2H-imidazole is CCCCCCCCCCN1C=CN(CC)C1.
What is the InChIKey of 1-decyl-3-ethyl-2H-imidazole?
The InChIKey is MKNCYIGQGNKLJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2/c1-3-5-6-7-8-9-10-11-12-17-14-13-16(4-2)15-17/h13-14H,3-12,15H2,1-2H3.
What are the key properties of 1-decyl-3-ethyl-2H-imidazole?
1-decyl-3-ethyl-2H-imidazole has a molecular weight of 238.42 g/mol, XLogP of 4.19, 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-2H-imidazole is sourced from PubChem (CID 19864130), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).