5-(4-methylphenyl)-3-[(4-methylphenyl)methylideneamino]imidazolidine-2,4-dione

C18H17N3O2 — CID 155292934

IUPAC5-(4-methylphenyl)-3-[(4-methylphenyl)methylideneamino]imidazolidine-2,4-dione
SMILESCc1ccc(C=NN2C(=O)NC(c3ccc(C)cc3)C2=O)cc1
InChIInChI=1S/C18H17N3O2/c1-12-3-7-14(8-4-12)11-19-21-17(22)16(20-18(21)23)15-9-5-13(2)6-10-15/h3-11,16H,1-2H3,(H,20,23)
InChIKeyBJHXHQHRXCWIHB-UHFFFAOYSA-N
MW307.35 g/mol
LogP2.93
Rot. Bonds3

About 5-(4-methylphenyl)-3-[(4-methylphenyl)methylideneamino]imidazolidine-2,4-dione

5-(4-methylphenyl)-3-[(4-methylphenyl)methylideneamino]imidazolidine-2,4-dione (PubChem CID 155292934) has the molecular formula C18H17N3O2 and a molecular weight of 307.35 g/mol. Its IUPAC name is 5-(4-methylphenyl)-3-[(4-methylphenyl)methylideneamino]imidazolidine-2,4-dione.

Molecular Properties

Compound Name5-(4-methylphenyl)-3-[(4-methylphenyl)methylideneamino]imidazolidine-2,4-dione
PubChem CID155292934
Molecular FormulaC18H17N3O2
Molecular Weight307.35 g/mol
Exact Mass307.13
IUPAC Name5-(4-methylphenyl)-3-[(4-methylphenyl)methylideneamino]imidazolidine-2,4-dione
SMILESCc1ccc(C=NN2C(=O)NC(c3ccc(C)cc3)C2=O)cc1
InChIInChI=1S/C18H17N3O2/c1-12-3-7-14(8-4-12)11-19-21-17(22)16(20-18(21)23)15-9-5-13(2)6-10-15/h3-11,16H,1-2H3,(H,20,23)
InChIKeyBJHXHQHRXCWIHB-UHFFFAOYSA-N
XLogP2.93
TPSA61.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.35
LogP ≤ 52.93
H-Bond Donors ≤ 51
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-(4-methylphenyl)-3-[(4-methylphenyl)methylideneamino]imidazolidine-2,4-dione?
The IUPAC name of 5-(4-methylphenyl)-3-[(4-methylphenyl)methylideneamino]imidazolidine-2,4-dione (CID 155292934) is 5-(4-methylphenyl)-3-[(4-methylphenyl)methylideneamino]imidazolidine-2,4-dione.
What is the SMILES notation for 5-(4-methylphenyl)-3-[(4-methylphenyl)methylideneamino]imidazolidine-2,4-dione?
The canonical SMILES for 5-(4-methylphenyl)-3-[(4-methylphenyl)methylideneamino]imidazolidine-2,4-dione is Cc1ccc(C=NN2C(=O)NC(c3ccc(C)cc3)C2=O)cc1.
What is the InChIKey of 5-(4-methylphenyl)-3-[(4-methylphenyl)methylideneamino]imidazolidine-2,4-dione?
The InChIKey is BJHXHQHRXCWIHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17N3O2/c1-12-3-7-14(8-4-12)11-19-21-17(22)16(20-18(21)23)15-9-5-13(2)6-10-15/h3-11,16H,1-2H3,(H,20,23).
What are the key properties of 5-(4-methylphenyl)-3-[(4-methylphenyl)methylideneamino]imidazolidine-2,4-dione?
5-(4-methylphenyl)-3-[(4-methylphenyl)methylideneamino]imidazolidine-2,4-dione has a molecular weight of 307.35 g/mol, XLogP of 2.93, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-methylphenyl)-3-[(4-methylphenyl)methylideneamino]imidazolidine-2,4-dione is sourced from PubChem (CID 155292934), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).