2-anilino-1-phenyl-4H-imidazol-5-one

C15H13N3O — CID 1454513

IUPAC2-anilino-1-phenyl-4H-imidazol-5-one
SMILESO=C1CN=C(Nc2ccccc2)N1c1ccccc1
InChIInChI=1S/C15H13N3O/c19-14-11-16-15(17-12-7-3-1-4-8-12)18(14)13-9-5-2-6-10-13/h1-10H,11H2,(H,16,17)
InChIKeyUZHSVSIKBKKDEI-UHFFFAOYSA-N
MW251.29 g/mol
LogP2.50
Rot. Bonds2

About 2-anilino-1-phenyl-4H-imidazol-5-one

2-anilino-1-phenyl-4H-imidazol-5-one (PubChem CID 1454513) has the molecular formula C15H13N3O and a molecular weight of 251.29 g/mol. Its IUPAC name is 2-anilino-1-phenyl-4H-imidazol-5-one.

Molecular Properties

Compound Name2-anilino-1-phenyl-4H-imidazol-5-one
PubChem CID1454513
Molecular FormulaC15H13N3O
Molecular Weight251.29 g/mol
Exact Mass251.11
IUPAC Name2-anilino-1-phenyl-4H-imidazol-5-one
SMILESO=C1CN=C(Nc2ccccc2)N1c1ccccc1
InChIInChI=1S/C15H13N3O/c19-14-11-16-15(17-12-7-3-1-4-8-12)18(14)13-9-5-2-6-10-13/h1-10H,11H2,(H,16,17)
InChIKeyUZHSVSIKBKKDEI-UHFFFAOYSA-N
XLogP2.50
TPSA44.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.29
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-anilino-1-phenyl-4H-imidazol-5-one?
The IUPAC name of 2-anilino-1-phenyl-4H-imidazol-5-one (CID 1454513) is 2-anilino-1-phenyl-4H-imidazol-5-one.
What is the SMILES notation for 2-anilino-1-phenyl-4H-imidazol-5-one?
The canonical SMILES for 2-anilino-1-phenyl-4H-imidazol-5-one is O=C1CN=C(Nc2ccccc2)N1c1ccccc1.
What is the InChIKey of 2-anilino-1-phenyl-4H-imidazol-5-one?
The InChIKey is UZHSVSIKBKKDEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13N3O/c19-14-11-16-15(17-12-7-3-1-4-8-12)18(14)13-9-5-2-6-10-13/h1-10H,11H2,(H,16,17).
What are the key properties of 2-anilino-1-phenyl-4H-imidazol-5-one?
2-anilino-1-phenyl-4H-imidazol-5-one has a molecular weight of 251.29 g/mol, XLogP of 2.50, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-anilino-1-phenyl-4H-imidazol-5-one is sourced from PubChem (CID 1454513), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).