2-(3-methoxyanilino)-1-phenyl-4H-imidazol-5-one

C16H15N3O2 — CID 1454517

IUPAC2-(3-methoxyanilino)-1-phenyl-4H-imidazol-5-one
SMILESCOc1cccc(NC2=NCC(=O)N2c2ccccc2)c1
InChIInChI=1S/C16H15N3O2/c1-21-14-9-5-6-12(10-14)18-16-17-11-15(20)19(16)13-7-3-2-4-8-13/h2-10H,11H2,1H3,(H,17,18)
InChIKeyHXUZZWRZGFMZQL-UHFFFAOYSA-N
MW281.32 g/mol
LogP2.51
Rot. Bonds3

About 2-(3-methoxyanilino)-1-phenyl-4H-imidazol-5-one

2-(3-methoxyanilino)-1-phenyl-4H-imidazol-5-one (PubChem CID 1454517) has the molecular formula C16H15N3O2 and a molecular weight of 281.32 g/mol. Its IUPAC name is 2-(3-methoxyanilino)-1-phenyl-4H-imidazol-5-one.

Molecular Properties

Compound Name2-(3-methoxyanilino)-1-phenyl-4H-imidazol-5-one
PubChem CID1454517
Molecular FormulaC16H15N3O2
Molecular Weight281.32 g/mol
Exact Mass281.12
IUPAC Name2-(3-methoxyanilino)-1-phenyl-4H-imidazol-5-one
SMILESCOc1cccc(NC2=NCC(=O)N2c2ccccc2)c1
InChIInChI=1S/C16H15N3O2/c1-21-14-9-5-6-12(10-14)18-16-17-11-15(20)19(16)13-7-3-2-4-8-13/h2-10H,11H2,1H3,(H,17,18)
InChIKeyHXUZZWRZGFMZQL-UHFFFAOYSA-N
XLogP2.51
TPSA53.93 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.32
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-(3-methoxyanilino)-1-phenyl-4H-imidazol-5-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(4-ethoxyphenyl)-2-(3-methoxyanilino)-4H-imidazol-5-one;hydrochloride
CID 171668608
1-(4-ethoxyphenyl)-2-(4-methoxyanilino)-4H-imidazol-5-one;hydrochloride
CID 171668609
2-(2-chloroanilino)-1-phenyl-4H-imidazol-5-one
CID 1454523
1-(4-ethoxyphenyl)-2-(4-fluoroanilino)-4H-imidazol-5-one
CID 1454551
3,4-bis(3-methoxyanilino)cyclobut-3-ene-1,2-dione
CID 2824412
1-(2,5-dimethylphenyl)-2-(4-methoxyanilino)-4H-imidazol-5-one;hydrochloride
CID 171668602
1-benzyl-2-(4-methoxyanilino)-4H-imidazol-5-one
CID 1454445
1-N,2-N-bis(3-methoxyphenyl)benzene-1,2-diamine
CID 19351985
3-chloro-4-(3-methoxyanilino)-1-(4-methoxyphenyl)pyrrole-2,5-dione
CID 1033968
3-(3-methoxyanilino)-4-(methylamino)cyclobut-3-ene-1,2-dione
CID 135173403
1-(3-fluorophenyl)-3-(3-methoxyanilino)-4-phenylpyrrole-2,5-dione
CID 110594991
3-(3-methoxyanilino)-4-phenyl-1-[4-(trifluoromethyl)phenyl]pyrrole-2,5-dione
CID 110596141

Frequently Asked Questions

What is the IUPAC name of 2-(3-methoxyanilino)-1-phenyl-4H-imidazol-5-one?
The IUPAC name of 2-(3-methoxyanilino)-1-phenyl-4H-imidazol-5-one (CID 1454517) is 2-(3-methoxyanilino)-1-phenyl-4H-imidazol-5-one.
What is the SMILES notation for 2-(3-methoxyanilino)-1-phenyl-4H-imidazol-5-one?
The canonical SMILES for 2-(3-methoxyanilino)-1-phenyl-4H-imidazol-5-one is COc1cccc(NC2=NCC(=O)N2c2ccccc2)c1.
What is the InChIKey of 2-(3-methoxyanilino)-1-phenyl-4H-imidazol-5-one?
The InChIKey is HXUZZWRZGFMZQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N3O2/c1-21-14-9-5-6-12(10-14)18-16-17-11-15(20)19(16)13-7-3-2-4-8-13/h2-10H,11H2,1H3,(H,17,18).
What are the key properties of 2-(3-methoxyanilino)-1-phenyl-4H-imidazol-5-one?
2-(3-methoxyanilino)-1-phenyl-4H-imidazol-5-one has a molecular weight of 281.32 g/mol, XLogP of 2.51, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methoxyanilino)-1-phenyl-4H-imidazol-5-one is sourced from PubChem (CID 1454517), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).