1-ethyl-2,4,5-trimethylimidazole

C8H14N2 — CID 24871657

IUPAC1-ethyl-2,4,5-trimethylimidazole
SMILESCCn1c(C)nc(C)c1C
InChIInChI=1S/C8H14N2/c1-5-10-7(3)6(2)9-8(10)4/h5H2,1-4H3
InChIKeyRPWMYGMYNIXMAP-UHFFFAOYSA-N
MW138.21 g/mol
LogP1.83
Rot. Bonds1

About 1-ethyl-2,4,5-trimethylimidazole

1-ethyl-2,4,5-trimethylimidazole (PubChem CID 24871657) has the molecular formula C8H14N2 and a molecular weight of 138.21 g/mol. Its IUPAC name is 1-ethyl-2,4,5-trimethylimidazole.

Molecular Properties

Compound Name1-ethyl-2,4,5-trimethylimidazole
PubChem CID24871657
Molecular FormulaC8H14N2
Molecular Weight138.21 g/mol
Exact Mass138.12
IUPAC Name1-ethyl-2,4,5-trimethylimidazole
SMILESCCn1c(C)nc(C)c1C
InChIInChI=1S/C8H14N2/c1-5-10-7(3)6(2)9-8(10)4/h5H2,1-4H3
InChIKeyRPWMYGMYNIXMAP-UHFFFAOYSA-N
XLogP1.83
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.21
LogP ≤ 51.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1,2,4,5-Tetramethyl-1H-imidazole
CID 74444
4-amino-1,2-dimethyl-1H-imidazole-5-carbonitrile
CID 12239847
trimethyl-1H-imidazole-1-carbonitrile
CID 45087624
2,4,5-Trimethyl-1H-imidazol-1-OL
CID 3271952
2-chloro-1,4,5-trimethyl-1H-imidazole
CID 17929113
3-(2,4,5-Trimethyl-1H-imidazol-1-yl)propan-1-amine
CID 18722289
1-(1,4,5-trimethyl-1H-imidazol-2-yl)ethan-1-one
CID 21028287
4-bromo-1,2,5-trimethyl-1H-imidazole
CID 30032997
1,4-dimethyl-1H-imidazol-5-amine
CID 45116671
2,3-dimethyl-5H,6H,7H,8H-imidazo(1,2-a)pyrazine
CID 50987626
1,4-dimethyl-1H-imidazol-5-amine hydrochloride
CID 74889882
2-bromo-1,4,5-trimethyl-1H-imidazole
CID 74890576

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-2,4,5-trimethylimidazole?
The IUPAC name of 1-ethyl-2,4,5-trimethylimidazole (CID 24871657) is 1-ethyl-2,4,5-trimethylimidazole.
What is the SMILES notation for 1-ethyl-2,4,5-trimethylimidazole?
The canonical SMILES for 1-ethyl-2,4,5-trimethylimidazole is CCn1c(C)nc(C)c1C.
What is the InChIKey of 1-ethyl-2,4,5-trimethylimidazole?
The InChIKey is RPWMYGMYNIXMAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2/c1-5-10-7(3)6(2)9-8(10)4/h5H2,1-4H3.
What are the key properties of 1-ethyl-2,4,5-trimethylimidazole?
1-ethyl-2,4,5-trimethylimidazole has a molecular weight of 138.21 g/mol, XLogP of 1.83, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-2,4,5-trimethylimidazole is sourced from PubChem (CID 24871657), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).