2-methylimino-5,5-diphenylimidazolidin-4-one

C16H15N3O — CID 135974495

IUPAC2-methylimino-5,5-diphenylimidazolidin-4-one
SMILESC/N=C1\NC(=O)C(c2ccccc2)(c2ccccc2)N1
InChIInChI=1S/C16H15N3O/c1-17-15-18-14(20)16(19-15,12-8-4-2-5-9-12)13-10-6-3-7-11-13/h2-11H,1H3,(H2,17,18,19,20)
InChIKeyBGAXBVYQJWKXBB-UHFFFAOYSA-N
MW265.32 g/mol
LogP1.64
Rot. Bonds2

About 2-methylimino-5,5-diphenylimidazolidin-4-one

2-methylimino-5,5-diphenylimidazolidin-4-one (PubChem CID 135974495) has the molecular formula C16H15N3O and a molecular weight of 265.32 g/mol. Its IUPAC name is 2-methylimino-5,5-diphenylimidazolidin-4-one.

Molecular Properties

Compound Name2-methylimino-5,5-diphenylimidazolidin-4-one
PubChem CID135974495
Molecular FormulaC16H15N3O
Molecular Weight265.32 g/mol
Exact Mass265.12
IUPAC Name2-methylimino-5,5-diphenylimidazolidin-4-one
SMILESC/N=C1\NC(=O)C(c2ccccc2)(c2ccccc2)N1
InChIInChI=1S/C16H15N3O/c1-17-15-18-14(20)16(19-15,12-8-4-2-5-9-12)13-10-6-3-7-11-13/h2-11H,1H3,(H2,17,18,19,20)
InChIKeyBGAXBVYQJWKXBB-UHFFFAOYSA-N
XLogP1.64
TPSA53.49 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.32
LogP ≤ 51.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

Phenytoin
CID 1775
Mephenytoin
CID 4060
Phenytoin Sodium
CID 657302
Nirvanol
CID 91480
(5S)-5-methyl-5-phenylimidazolidine-2,4-dione
CID 640021
Mephenytoin, (+)-
CID 107921
5-Phenyl-5-propylimidazolidine-2,4-dione
CID 219572
(+)-Nirvanol
CID 6540813
5-Methyl-5-phenylhydantoin
CID 93043
Doxenitoin
CID 18622
Methetoin
CID 21908
5-(4'-Methylphenyl)-5-phenylhydantoin
CID 92334

Frequently Asked Questions

What is the IUPAC name of 2-methylimino-5,5-diphenylimidazolidin-4-one?
The IUPAC name of 2-methylimino-5,5-diphenylimidazolidin-4-one (CID 135974495) is 2-methylimino-5,5-diphenylimidazolidin-4-one.
What is the SMILES notation for 2-methylimino-5,5-diphenylimidazolidin-4-one?
The canonical SMILES for 2-methylimino-5,5-diphenylimidazolidin-4-one is C/N=C1\NC(=O)C(c2ccccc2)(c2ccccc2)N1.
What is the InChIKey of 2-methylimino-5,5-diphenylimidazolidin-4-one?
The InChIKey is BGAXBVYQJWKXBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N3O/c1-17-15-18-14(20)16(19-15,12-8-4-2-5-9-12)13-10-6-3-7-11-13/h2-11H,1H3,(H2,17,18,19,20).
What are the key properties of 2-methylimino-5,5-diphenylimidazolidin-4-one?
2-methylimino-5,5-diphenylimidazolidin-4-one has a molecular weight of 265.32 g/mol, XLogP of 1.64, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methylimino-5,5-diphenylimidazolidin-4-one is sourced from PubChem (CID 135974495), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).