5-(benzylideneamino)-3-methyl-1-phenylimidazolidine-2,4-dione

C17H15N3O2 — CID 4524943

IUPAC5-(benzylideneamino)-3-methyl-1-phenylimidazolidine-2,4-dione
SMILESCN1C(=O)C(N=Cc2ccccc2)N(c2ccccc2)C1=O
InChIInChI=1S/C17H15N3O2/c1-19-16(21)15(18-12-13-8-4-2-5-9-13)20(17(19)22)14-10-6-3-7-11-14/h2-12,15H,1H3
InChIKeyIWLOZTSBMZWMME-UHFFFAOYSA-N
MW293.33 g/mol
LogP2.53
Rot. Bonds3

About 5-(benzylideneamino)-3-methyl-1-phenylimidazolidine-2,4-dione

5-(benzylideneamino)-3-methyl-1-phenylimidazolidine-2,4-dione (PubChem CID 4524943) has the molecular formula C17H15N3O2 and a molecular weight of 293.33 g/mol. Its IUPAC name is 5-(benzylideneamino)-3-methyl-1-phenylimidazolidine-2,4-dione.

Molecular Properties

Compound Name5-(benzylideneamino)-3-methyl-1-phenylimidazolidine-2,4-dione
PubChem CID4524943
Molecular FormulaC17H15N3O2
Molecular Weight293.33 g/mol
Exact Mass293.12
IUPAC Name5-(benzylideneamino)-3-methyl-1-phenylimidazolidine-2,4-dione
SMILESCN1C(=O)C(N=Cc2ccccc2)N(c2ccccc2)C1=O
InChIInChI=1S/C17H15N3O2/c1-19-16(21)15(18-12-13-8-4-2-5-9-13)20(17(19)22)14-10-6-3-7-11-14/h2-12,15H,1H3
InChIKeyIWLOZTSBMZWMME-UHFFFAOYSA-N
XLogP2.53
TPSA52.98 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.33
LogP ≤ 52.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydantoin', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 5-(benzylideneamino)-3-methyl-1-phenylimidazolidine-2,4-dione?
The IUPAC name of 5-(benzylideneamino)-3-methyl-1-phenylimidazolidine-2,4-dione (CID 4524943) is 5-(benzylideneamino)-3-methyl-1-phenylimidazolidine-2,4-dione.
What is the SMILES notation for 5-(benzylideneamino)-3-methyl-1-phenylimidazolidine-2,4-dione?
The canonical SMILES for 5-(benzylideneamino)-3-methyl-1-phenylimidazolidine-2,4-dione is CN1C(=O)C(N=Cc2ccccc2)N(c2ccccc2)C1=O.
What is the InChIKey of 5-(benzylideneamino)-3-methyl-1-phenylimidazolidine-2,4-dione?
The InChIKey is IWLOZTSBMZWMME-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N3O2/c1-19-16(21)15(18-12-13-8-4-2-5-9-13)20(17(19)22)14-10-6-3-7-11-14/h2-12,15H,1H3.
What are the key properties of 5-(benzylideneamino)-3-methyl-1-phenylimidazolidine-2,4-dione?
5-(benzylideneamino)-3-methyl-1-phenylimidazolidine-2,4-dione has a molecular weight of 293.33 g/mol, XLogP of 2.53, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(benzylideneamino)-3-methyl-1-phenylimidazolidine-2,4-dione is sourced from PubChem (CID 4524943), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).