1-(2-fluoroethyl)-4,5-dimethylimidazole

C7H11FN2 — CID 115694990

IUPAC1-(2-fluoroethyl)-4,5-dimethylimidazole
SMILESCc1ncn(CCF)c1C
InChIInChI=1S/C7H11FN2/c1-6-7(2)10(4-3-8)5-9-6/h5H,3-4H2,1-2H3
InChIKeyFQFQSJNVRDASNM-UHFFFAOYSA-N
MW142.18 g/mol
LogP1.47
Rot. Bonds2

About 1-(2-fluoroethyl)-4,5-dimethylimidazole

1-(2-fluoroethyl)-4,5-dimethylimidazole (PubChem CID 115694990) has the molecular formula C7H11FN2 and a molecular weight of 142.18 g/mol. Its IUPAC name is 1-(2-fluoroethyl)-4,5-dimethylimidazole.

Molecular Properties

Compound Name1-(2-fluoroethyl)-4,5-dimethylimidazole
PubChem CID115694990
Molecular FormulaC7H11FN2
Molecular Weight142.18 g/mol
Exact Mass142.09
IUPAC Name1-(2-fluoroethyl)-4,5-dimethylimidazole
SMILESCc1ncn(CCF)c1C
InChIInChI=1S/C7H11FN2/c1-6-7(2)10(4-3-8)5-9-6/h5H,3-4H2,1-2H3
InChIKeyFQFQSJNVRDASNM-UHFFFAOYSA-N
XLogP1.47
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.18
LogP ≤ 51.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 1-(2-fluoroethyl)-4,5-dimethylimidazole 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

1,5-Dimethylimidazole
CID 139158
1,4-Dimethylimidazole
CID 138733
1,2,4,5-Tetramethyl-1H-imidazole
CID 74444
1-Butyl-5-methyl-1H-imidazole
CID 426631
1H-Imidazole, 1-butyl-4-methyl
CID 529330
trimethyl-1H-imidazole-1-carbonitrile
CID 45087624
2-chloro-1,4,5-trimethyl-1H-imidazole
CID 17929113
1,4-dimethyl-1H-imidazol-5-amine
CID 45116671
1,4-dimethyl-1H-imidazol-5-amine hydrochloride
CID 74889882
2-bromo-1,4,5-trimethyl-1H-imidazole
CID 74890576
1H-Imidazole-1-ethanamine, 4,5-dimethyl-, hydrochloride (1:2)
CID 75531085
1,2-Dimethyl-4-(trifluoromethyl)-1h-imidazole
CID 12747526

Frequently Asked Questions

What is the IUPAC name of 1-(2-fluoroethyl)-4,5-dimethylimidazole?
The IUPAC name of 1-(2-fluoroethyl)-4,5-dimethylimidazole (CID 115694990) is 1-(2-fluoroethyl)-4,5-dimethylimidazole.
What is the SMILES notation for 1-(2-fluoroethyl)-4,5-dimethylimidazole?
The canonical SMILES for 1-(2-fluoroethyl)-4,5-dimethylimidazole is Cc1ncn(CCF)c1C.
What is the InChIKey of 1-(2-fluoroethyl)-4,5-dimethylimidazole?
The InChIKey is FQFQSJNVRDASNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11FN2/c1-6-7(2)10(4-3-8)5-9-6/h5H,3-4H2,1-2H3.
What are the key properties of 1-(2-fluoroethyl)-4,5-dimethylimidazole?
1-(2-fluoroethyl)-4,5-dimethylimidazole has a molecular weight of 142.18 g/mol, XLogP of 1.47, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-fluoroethyl)-4,5-dimethylimidazole is sourced from PubChem (CID 115694990), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).