phenyl-(2-phenyl-4,5-dihydroimidazol-1-yl)methanone

C16H14N2O — CID 777294

IUPACphenyl-(2-phenyl-4,5-dihydroimidazol-1-yl)methanone
SMILESO=C(c1ccccc1)N1CCN=C1c1ccccc1
InChIInChI=1S/C16H14N2O/c19-16(14-9-5-2-6-10-14)18-12-11-17-15(18)13-7-3-1-4-8-13/h1-10H,11-12H2
InChIKeyHCXBTPLQOARCNC-UHFFFAOYSA-N
MW250.30 g/mol
LogP2.59
Rot. Bonds2

About phenyl-(2-phenyl-4,5-dihydroimidazol-1-yl)methanone

phenyl-(2-phenyl-4,5-dihydroimidazol-1-yl)methanone (PubChem CID 777294) has the molecular formula C16H14N2O and a molecular weight of 250.30 g/mol. Its IUPAC name is phenyl-(2-phenyl-4,5-dihydroimidazol-1-yl)methanone.

Molecular Properties

Compound Namephenyl-(2-phenyl-4,5-dihydroimidazol-1-yl)methanone
PubChem CID777294
Molecular FormulaC16H14N2O
Molecular Weight250.30 g/mol
Exact Mass250.11
IUPAC Namephenyl-(2-phenyl-4,5-dihydroimidazol-1-yl)methanone
SMILESO=C(c1ccccc1)N1CCN=C1c1ccccc1
InChIInChI=1S/C16H14N2O/c19-16(14-9-5-2-6-10-14)18-12-11-17-15(18)13-7-3-1-4-8-13/h1-10H,11-12H2
InChIKeyHCXBTPLQOARCNC-UHFFFAOYSA-N
XLogP2.59
TPSA32.67 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.30
LogP ≤ 52.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of phenyl-(2-phenyl-4,5-dihydroimidazol-1-yl)methanone?
The IUPAC name of phenyl-(2-phenyl-4,5-dihydroimidazol-1-yl)methanone (CID 777294) is phenyl-(2-phenyl-4,5-dihydroimidazol-1-yl)methanone.
What is the SMILES notation for phenyl-(2-phenyl-4,5-dihydroimidazol-1-yl)methanone?
The canonical SMILES for phenyl-(2-phenyl-4,5-dihydroimidazol-1-yl)methanone is O=C(c1ccccc1)N1CCN=C1c1ccccc1.
What is the InChIKey of phenyl-(2-phenyl-4,5-dihydroimidazol-1-yl)methanone?
The InChIKey is HCXBTPLQOARCNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N2O/c19-16(14-9-5-2-6-10-14)18-12-11-17-15(18)13-7-3-1-4-8-13/h1-10H,11-12H2.
What are the key properties of phenyl-(2-phenyl-4,5-dihydroimidazol-1-yl)methanone?
phenyl-(2-phenyl-4,5-dihydroimidazol-1-yl)methanone has a molecular weight of 250.30 g/mol, XLogP of 2.59, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for phenyl-(2-phenyl-4,5-dihydroimidazol-1-yl)methanone is sourced from PubChem (CID 777294), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).