5-ethyl-2-phenyl-1H-imidazole

C11H12N2 — CID 817462

IUPAC5-ethyl-2-phenyl-1H-imidazole
SMILESCCc1cnc(-c2ccccc2)[nH]1
InChIInChI=1S/C11H12N2/c1-2-10-8-12-11(13-10)9-6-4-3-5-7-9/h3-8H,2H2,1H3,(H,12,13)
InChIKeyBQUSIXSOCHTUCV-UHFFFAOYSA-N
MW172.23 g/mol
LogP2.64
Rot. Bonds2

About 5-ethyl-2-phenyl-1H-imidazole

5-ethyl-2-phenyl-1H-imidazole (PubChem CID 817462) has the molecular formula C11H12N2 and a molecular weight of 172.23 g/mol. Its IUPAC name is 5-ethyl-2-phenyl-1H-imidazole.

Molecular Properties

Compound Name5-ethyl-2-phenyl-1H-imidazole
PubChem CID817462
Molecular FormulaC11H12N2
Molecular Weight172.23 g/mol
Exact Mass172.10
IUPAC Name5-ethyl-2-phenyl-1H-imidazole
SMILESCCc1cnc(-c2ccccc2)[nH]1
InChIInChI=1S/C11H12N2/c1-2-10-8-12-11(13-10)9-6-4-3-5-7-9/h3-8H,2H2,1H3,(H,12,13)
InChIKeyBQUSIXSOCHTUCV-UHFFFAOYSA-N
XLogP2.64
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.23
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 5-ethyl-2-phenyl-1H-imidazole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-2-phenyl-1H-imidazole?
The IUPAC name of 5-ethyl-2-phenyl-1H-imidazole (CID 817462) is 5-ethyl-2-phenyl-1H-imidazole.
What is the SMILES notation for 5-ethyl-2-phenyl-1H-imidazole?
The canonical SMILES for 5-ethyl-2-phenyl-1H-imidazole is CCc1cnc(-c2ccccc2)[nH]1.
What is the InChIKey of 5-ethyl-2-phenyl-1H-imidazole?
The InChIKey is BQUSIXSOCHTUCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2/c1-2-10-8-12-11(13-10)9-6-4-3-5-7-9/h3-8H,2H2,1H3,(H,12,13).
What are the key properties of 5-ethyl-2-phenyl-1H-imidazole?
5-ethyl-2-phenyl-1H-imidazole has a molecular weight of 172.23 g/mol, XLogP of 2.64, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-2-phenyl-1H-imidazole is sourced from PubChem (CID 817462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).