2-[2-(4-fluorophenyl)ethyl]-4,5-dihydro-1H-imidazole

C11H13FN2 — CID 23184047

IUPAC2-[2-(4-fluorophenyl)ethyl]-4,5-dihydro-1H-imidazole
SMILESFc1ccc(CCC2=NCCN2)cc1
InChIInChI=1S/C11H13FN2/c12-10-4-1-9(2-5-10)3-6-11-13-7-8-14-11/h1-2,4-5H,3,6-8H2,(H,13,14)
InChIKeyOIKLGQRCQSUBAT-UHFFFAOYSA-N
MW192.24 g/mol
LogP1.76
Rot. Bonds3

About 2-[2-(4-fluorophenyl)ethyl]-4,5-dihydro-1H-imidazole

2-[2-(4-fluorophenyl)ethyl]-4,5-dihydro-1H-imidazole (PubChem CID 23184047) has the molecular formula C11H13FN2 and a molecular weight of 192.24 g/mol. Its IUPAC name is 2-[2-(4-fluorophenyl)ethyl]-4,5-dihydro-1H-imidazole.

Molecular Properties

Compound Name2-[2-(4-fluorophenyl)ethyl]-4,5-dihydro-1H-imidazole
PubChem CID23184047
Molecular FormulaC11H13FN2
Molecular Weight192.24 g/mol
Exact Mass192.11
IUPAC Name2-[2-(4-fluorophenyl)ethyl]-4,5-dihydro-1H-imidazole
SMILESFc1ccc(CCC2=NCCN2)cc1
InChIInChI=1S/C11H13FN2/c12-10-4-1-9(2-5-10)3-6-11-13-7-8-14-11/h1-2,4-5H,3,6-8H2,(H,13,14)
InChIKeyOIKLGQRCQSUBAT-UHFFFAOYSA-N
XLogP1.76
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.24
LogP ≤ 51.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[2-(4-fluorophenyl)ethyl]-4,5-dihydro-1H-imidazole?
The IUPAC name of 2-[2-(4-fluorophenyl)ethyl]-4,5-dihydro-1H-imidazole (CID 23184047) is 2-[2-(4-fluorophenyl)ethyl]-4,5-dihydro-1H-imidazole.
What is the SMILES notation for 2-[2-(4-fluorophenyl)ethyl]-4,5-dihydro-1H-imidazole?
The canonical SMILES for 2-[2-(4-fluorophenyl)ethyl]-4,5-dihydro-1H-imidazole is Fc1ccc(CCC2=NCCN2)cc1.
What is the InChIKey of 2-[2-(4-fluorophenyl)ethyl]-4,5-dihydro-1H-imidazole?
The InChIKey is OIKLGQRCQSUBAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13FN2/c12-10-4-1-9(2-5-10)3-6-11-13-7-8-14-11/h1-2,4-5H,3,6-8H2,(H,13,14).
What are the key properties of 2-[2-(4-fluorophenyl)ethyl]-4,5-dihydro-1H-imidazole?
2-[2-(4-fluorophenyl)ethyl]-4,5-dihydro-1H-imidazole has a molecular weight of 192.24 g/mol, XLogP of 1.76, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(4-fluorophenyl)ethyl]-4,5-dihydro-1H-imidazole is sourced from PubChem (CID 23184047), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).