2-methyl-5-(2-phenylethenyl)-1H-imidazole

C12H12N2 — CID 175264708

IUPAC2-methyl-5-(2-phenylethenyl)-1H-imidazole
SMILESCc1ncc(C=Cc2ccccc2)[nH]1
InChIInChI=1S/C12H12N2/c1-10-13-9-12(14-10)8-7-11-5-3-2-4-6-11/h2-9H,1H3,(H,13,14)
InChIKeyCCDFZZPVFZQILF-UHFFFAOYSA-N
MW184.24 g/mol
LogP2.89
Rot. Bonds2

About 2-methyl-5-(2-phenylethenyl)-1H-imidazole

2-methyl-5-(2-phenylethenyl)-1H-imidazole (PubChem CID 175264708) has the molecular formula C12H12N2 and a molecular weight of 184.24 g/mol. Its IUPAC name is 2-methyl-5-(2-phenylethenyl)-1H-imidazole.

Molecular Properties

Compound Name2-methyl-5-(2-phenylethenyl)-1H-imidazole
PubChem CID175264708
Molecular FormulaC12H12N2
Molecular Weight184.24 g/mol
Exact Mass184.10
IUPAC Name2-methyl-5-(2-phenylethenyl)-1H-imidazole
SMILESCc1ncc(C=Cc2ccccc2)[nH]1
InChIInChI=1S/C12H12N2/c1-10-13-9-12(14-10)8-7-11-5-3-2-4-6-11/h2-9H,1H3,(H,13,14)
InChIKeyCCDFZZPVFZQILF-UHFFFAOYSA-N
XLogP2.89
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.24
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-5-(2-phenylethenyl)-1H-imidazole?
The IUPAC name of 2-methyl-5-(2-phenylethenyl)-1H-imidazole (CID 175264708) is 2-methyl-5-(2-phenylethenyl)-1H-imidazole.
What is the SMILES notation for 2-methyl-5-(2-phenylethenyl)-1H-imidazole?
The canonical SMILES for 2-methyl-5-(2-phenylethenyl)-1H-imidazole is Cc1ncc(C=Cc2ccccc2)[nH]1.
What is the InChIKey of 2-methyl-5-(2-phenylethenyl)-1H-imidazole?
The InChIKey is CCDFZZPVFZQILF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N2/c1-10-13-9-12(14-10)8-7-11-5-3-2-4-6-11/h2-9H,1H3,(H,13,14).
What are the key properties of 2-methyl-5-(2-phenylethenyl)-1H-imidazole?
2-methyl-5-(2-phenylethenyl)-1H-imidazole has a molecular weight of 184.24 g/mol, XLogP of 2.89, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-5-(2-phenylethenyl)-1H-imidazole is sourced from PubChem (CID 175264708), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).