4-(2-methoxyethyl)-5-methyl-2-phenyl-1H-imidazole

C13H16N2O — CID 70591932

IUPAC4-(2-methoxyethyl)-5-methyl-2-phenyl-1H-imidazole
SMILESCOCCc1nc(-c2ccccc2)[nH]c1C
InChIInChI=1S/C13H16N2O/c1-10-12(8-9-16-2)15-13(14-10)11-6-4-3-5-7-11/h3-7H,8-9H2,1-2H3,(H,14,15)
InChIKeyILOBIFYORMRSKO-UHFFFAOYSA-N
MW216.28 g/mol
LogP2.57
Rot. Bonds4

About 4-(2-methoxyethyl)-5-methyl-2-phenyl-1H-imidazole

4-(2-methoxyethyl)-5-methyl-2-phenyl-1H-imidazole (PubChem CID 70591932) has the molecular formula C13H16N2O and a molecular weight of 216.28 g/mol. Its IUPAC name is 4-(2-methoxyethyl)-5-methyl-2-phenyl-1H-imidazole.

Molecular Properties

Compound Name4-(2-methoxyethyl)-5-methyl-2-phenyl-1H-imidazole
PubChem CID70591932
Molecular FormulaC13H16N2O
Molecular Weight216.28 g/mol
Exact Mass216.13
IUPAC Name4-(2-methoxyethyl)-5-methyl-2-phenyl-1H-imidazole
SMILESCOCCc1nc(-c2ccccc2)[nH]c1C
InChIInChI=1S/C13H16N2O/c1-10-12(8-9-16-2)15-13(14-10)11-6-4-3-5-7-11/h3-7H,8-9H2,1-2H3,(H,14,15)
InChIKeyILOBIFYORMRSKO-UHFFFAOYSA-N
XLogP2.57
TPSA37.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.28
LogP ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-(2-methoxyethyl)-5-methyl-2-phenyl-1H-imidazole?
The IUPAC name of 4-(2-methoxyethyl)-5-methyl-2-phenyl-1H-imidazole (CID 70591932) is 4-(2-methoxyethyl)-5-methyl-2-phenyl-1H-imidazole.
What is the SMILES notation for 4-(2-methoxyethyl)-5-methyl-2-phenyl-1H-imidazole?
The canonical SMILES for 4-(2-methoxyethyl)-5-methyl-2-phenyl-1H-imidazole is COCCc1nc(-c2ccccc2)[nH]c1C.
What is the InChIKey of 4-(2-methoxyethyl)-5-methyl-2-phenyl-1H-imidazole?
The InChIKey is ILOBIFYORMRSKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N2O/c1-10-12(8-9-16-2)15-13(14-10)11-6-4-3-5-7-11/h3-7H,8-9H2,1-2H3,(H,14,15).
What are the key properties of 4-(2-methoxyethyl)-5-methyl-2-phenyl-1H-imidazole?
4-(2-methoxyethyl)-5-methyl-2-phenyl-1H-imidazole has a molecular weight of 216.28 g/mol, XLogP of 2.57, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-methoxyethyl)-5-methyl-2-phenyl-1H-imidazole is sourced from PubChem (CID 70591932), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).