1-(4,5-diphenyl-1H-imidazol-2-yl)-2-hydroxyethanone

C17H14N2O2 — CID 67414953

IUPAC1-(4,5-diphenyl-1H-imidazol-2-yl)-2-hydroxyethanone
SMILESO=C(CO)c1nc(-c2ccccc2)c(-c2ccccc2)[nH]1
InChIInChI=1S/C17H14N2O2/c20-11-14(21)17-18-15(12-7-3-1-4-8-12)16(19-17)13-9-5-2-6-10-13/h1-10,20H,11H2,(H,18,19)
InChIKeyIGLTUQVIJFJCNN-UHFFFAOYSA-N
MW278.31 g/mol
LogP2.92
Rot. Bonds4

About 1-(4,5-diphenyl-1H-imidazol-2-yl)-2-hydroxyethanone

1-(4,5-diphenyl-1H-imidazol-2-yl)-2-hydroxyethanone (PubChem CID 67414953) has the molecular formula C17H14N2O2 and a molecular weight of 278.31 g/mol. Its IUPAC name is 1-(4,5-diphenyl-1H-imidazol-2-yl)-2-hydroxyethanone.

Molecular Properties

Compound Name1-(4,5-diphenyl-1H-imidazol-2-yl)-2-hydroxyethanone
PubChem CID67414953
Molecular FormulaC17H14N2O2
Molecular Weight278.31 g/mol
Exact Mass278.11
IUPAC Name1-(4,5-diphenyl-1H-imidazol-2-yl)-2-hydroxyethanone
SMILESO=C(CO)c1nc(-c2ccccc2)c(-c2ccccc2)[nH]1
InChIInChI=1S/C17H14N2O2/c20-11-14(21)17-18-15(12-7-3-1-4-8-12)16(19-17)13-9-5-2-6-10-13/h1-10,20H,11H2,(H,18,19)
InChIKeyIGLTUQVIJFJCNN-UHFFFAOYSA-N
XLogP2.92
TPSA65.98 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.31
LogP ≤ 52.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(4,5-diphenyl-1H-imidazol-2-yl)-2-hydroxyethanone?
The IUPAC name of 1-(4,5-diphenyl-1H-imidazol-2-yl)-2-hydroxyethanone (CID 67414953) is 1-(4,5-diphenyl-1H-imidazol-2-yl)-2-hydroxyethanone.
What is the SMILES notation for 1-(4,5-diphenyl-1H-imidazol-2-yl)-2-hydroxyethanone?
The canonical SMILES for 1-(4,5-diphenyl-1H-imidazol-2-yl)-2-hydroxyethanone is O=C(CO)c1nc(-c2ccccc2)c(-c2ccccc2)[nH]1.
What is the InChIKey of 1-(4,5-diphenyl-1H-imidazol-2-yl)-2-hydroxyethanone?
The InChIKey is IGLTUQVIJFJCNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14N2O2/c20-11-14(21)17-18-15(12-7-3-1-4-8-12)16(19-17)13-9-5-2-6-10-13/h1-10,20H,11H2,(H,18,19).
What are the key properties of 1-(4,5-diphenyl-1H-imidazol-2-yl)-2-hydroxyethanone?
1-(4,5-diphenyl-1H-imidazol-2-yl)-2-hydroxyethanone has a molecular weight of 278.31 g/mol, XLogP of 2.92, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4,5-diphenyl-1H-imidazol-2-yl)-2-hydroxyethanone is sourced from PubChem (CID 67414953), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).