4-ethyl-1-methylimidazole

C6H10N2 — CID 20517177

IUPAC4-ethyl-1-methylimidazole
SMILESCCc1cn(C)cn1
InChIInChI=1S/C6H10N2/c1-3-6-4-8(2)5-7-6/h4-5H,3H2,1-2H3
InChIKeyQEFLNYXPYKZGEX-UHFFFAOYSA-N
MW110.16 g/mol
LogP0.98
Rot. Bonds1

About 4-ethyl-1-methylimidazole

4-ethyl-1-methylimidazole (PubChem CID 20517177) has the molecular formula C6H10N2 and a molecular weight of 110.16 g/mol. Its IUPAC name is 4-ethyl-1-methylimidazole.

Molecular Properties

Compound Name4-ethyl-1-methylimidazole
PubChem CID20517177
Molecular FormulaC6H10N2
Molecular Weight110.16 g/mol
Exact Mass110.08
IUPAC Name4-ethyl-1-methylimidazole
SMILESCCc1cn(C)cn1
InChIInChI=1S/C6H10N2/c1-3-6-4-8(2)5-7-6/h4-5H,3H2,1-2H3
InChIKeyQEFLNYXPYKZGEX-UHFFFAOYSA-N
XLogP0.98
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500110.16
LogP ≤ 50.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-methyl-4-propylimidazole
CID 20703275
ethane;2-(1-methylimidazol-4-yl)acetonitrile
CID 145259968
4-(3,3-dimethylbutyl)-1-methylimidazole
CID 59832140
tributyl-[(1-methylimidazol-4-yl)methyl]stannane
CID 169086685
1,1-dimethyl-2-[(1-methylimidazol-4-yl)methyl]hydrazine
CID 130598738
ethyl 2-(1-methylimidazol-4-yl)acetate
CID 77134384
(2S)-N-chloro-1-(1-methylimidazol-4-yl)propan-2-amine
CID 88999055
2-(1-methylimidazol-4-yl)ethanethioamide;hydrochloride
CID 19417708
4-(1-methylimidazol-4-yl)butan-2-ol
CID 130509414
ethane;4-ethyl-1-pentylimidazole
CID 142090904
(2S)-2-hydroxy-3-(1-methylimidazol-4-yl)propanoic acid
CID 125425063
3-(1-methylimidazol-4-yl)propanamide;hydrochloride
CID 22069238

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-1-methylimidazole?
The IUPAC name of 4-ethyl-1-methylimidazole (CID 20517177) is 4-ethyl-1-methylimidazole.
What is the SMILES notation for 4-ethyl-1-methylimidazole?
The canonical SMILES for 4-ethyl-1-methylimidazole is CCc1cn(C)cn1.
What is the InChIKey of 4-ethyl-1-methylimidazole?
The InChIKey is QEFLNYXPYKZGEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N2/c1-3-6-4-8(2)5-7-6/h4-5H,3H2,1-2H3.
What are the key properties of 4-ethyl-1-methylimidazole?
4-ethyl-1-methylimidazole has a molecular weight of 110.16 g/mol, XLogP of 0.98, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-1-methylimidazole is sourced from PubChem (CID 20517177), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).