2,4,5-triethyl-1-methylimidazole

C10H18N2 — CID 141155597

IUPAC2,4,5-triethyl-1-methylimidazole
SMILESCCc1nc(CC)n(C)c1CC
InChIInChI=1S/C10H18N2/c1-5-8-9(6-2)12(4)10(7-3)11-8/h5-7H2,1-4H3
InChIKeyMUDDNAVFHIVRNC-UHFFFAOYSA-N
MW166.27 g/mol
LogP2.11
Rot. Bonds3

About 2,4,5-triethyl-1-methylimidazole

2,4,5-triethyl-1-methylimidazole (PubChem CID 141155597) has the molecular formula C10H18N2 and a molecular weight of 166.27 g/mol. Its IUPAC name is 2,4,5-triethyl-1-methylimidazole.

Molecular Properties

Compound Name2,4,5-triethyl-1-methylimidazole
PubChem CID141155597
Molecular FormulaC10H18N2
Molecular Weight166.27 g/mol
Exact Mass166.15
IUPAC Name2,4,5-triethyl-1-methylimidazole
SMILESCCc1nc(CC)n(C)c1CC
InChIInChI=1S/C10H18N2/c1-5-8-9(6-2)12(4)10(7-3)11-8/h5-7H2,1-4H3
InChIKeyMUDDNAVFHIVRNC-UHFFFAOYSA-N
XLogP2.11
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.27
LogP ≤ 52.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,4,5-triethyl-1-methylimidazole?
The IUPAC name of 2,4,5-triethyl-1-methylimidazole (CID 141155597) is 2,4,5-triethyl-1-methylimidazole.
What is the SMILES notation for 2,4,5-triethyl-1-methylimidazole?
The canonical SMILES for 2,4,5-triethyl-1-methylimidazole is CCc1nc(CC)n(C)c1CC.
What is the InChIKey of 2,4,5-triethyl-1-methylimidazole?
The InChIKey is MUDDNAVFHIVRNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2/c1-5-8-9(6-2)12(4)10(7-3)11-8/h5-7H2,1-4H3.
What are the key properties of 2,4,5-triethyl-1-methylimidazole?
2,4,5-triethyl-1-methylimidazole has a molecular weight of 166.27 g/mol, XLogP of 2.11, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4,5-triethyl-1-methylimidazole is sourced from PubChem (CID 141155597), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).