1-ethyl-4-(4-fluorophenyl)-2-methyl-4,5-dihydroimidazole

C12H15FN2 — CID 91166266

IUPAC1-ethyl-4-(4-fluorophenyl)-2-methyl-4,5-dihydroimidazole
SMILESCCN1CC(c2ccc(F)cc2)N=C1C
InChIInChI=1S/C12H15FN2/c1-3-15-8-12(14-9(15)2)10-4-6-11(13)7-5-10/h4-7,12H,3,8H2,1-2H3
InChIKeyRBJGRHKJWUXFMT-UHFFFAOYSA-N
MW206.26 g/mol
LogP2.62
Rot. Bonds2

About 1-ethyl-4-(4-fluorophenyl)-2-methyl-4,5-dihydroimidazole

1-ethyl-4-(4-fluorophenyl)-2-methyl-4,5-dihydroimidazole (PubChem CID 91166266) has the molecular formula C12H15FN2 and a molecular weight of 206.26 g/mol. Its IUPAC name is 1-ethyl-4-(4-fluorophenyl)-2-methyl-4,5-dihydroimidazole.

Molecular Properties

Compound Name1-ethyl-4-(4-fluorophenyl)-2-methyl-4,5-dihydroimidazole
PubChem CID91166266
Molecular FormulaC12H15FN2
Molecular Weight206.26 g/mol
Exact Mass206.12
IUPAC Name1-ethyl-4-(4-fluorophenyl)-2-methyl-4,5-dihydroimidazole
SMILESCCN1CC(c2ccc(F)cc2)N=C1C
InChIInChI=1S/C12H15FN2/c1-3-15-8-12(14-9(15)2)10-4-6-11(13)7-5-10/h4-7,12H,3,8H2,1-2H3
InChIKeyRBJGRHKJWUXFMT-UHFFFAOYSA-N
XLogP2.62
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.26
LogP ≤ 52.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-ethyl-4-(4-fluorophenyl)-2-methyl-4,5-dihydroimidazole?
The IUPAC name of 1-ethyl-4-(4-fluorophenyl)-2-methyl-4,5-dihydroimidazole (CID 91166266) is 1-ethyl-4-(4-fluorophenyl)-2-methyl-4,5-dihydroimidazole.
What is the SMILES notation for 1-ethyl-4-(4-fluorophenyl)-2-methyl-4,5-dihydroimidazole?
The canonical SMILES for 1-ethyl-4-(4-fluorophenyl)-2-methyl-4,5-dihydroimidazole is CCN1CC(c2ccc(F)cc2)N=C1C.
What is the InChIKey of 1-ethyl-4-(4-fluorophenyl)-2-methyl-4,5-dihydroimidazole?
The InChIKey is RBJGRHKJWUXFMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15FN2/c1-3-15-8-12(14-9(15)2)10-4-6-11(13)7-5-10/h4-7,12H,3,8H2,1-2H3.
What are the key properties of 1-ethyl-4-(4-fluorophenyl)-2-methyl-4,5-dihydroimidazole?
1-ethyl-4-(4-fluorophenyl)-2-methyl-4,5-dihydroimidazole has a molecular weight of 206.26 g/mol, XLogP of 2.62, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-4-(4-fluorophenyl)-2-methyl-4,5-dihydroimidazole is sourced from PubChem (CID 91166266), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).