5-(2,4-dimethylphenyl)-5-methyl-3-[3-(2-methylimidazol-1-yl)propyl]imidazolidine-2,4-dione

C19H24N4O2 — CID 84593571

IUPAC5-(2,4-dimethylphenyl)-5-methyl-3-[3-(2-methylimidazol-1-yl)propyl]imidazolidine-2,4-dione
SMILESCc1ccc(C2(C)NC(=O)N(CCCn3ccnc3C)C2=O)c(C)c1
InChIInChI=1S/C19H24N4O2/c1-13-6-7-16(14(2)12-13)19(4)17(24)23(18(25)21-19)10-5-9-22-11-8-20-15(22)3/h6-8,11-12H,5,9-10H2,1-4H3,(H,21,25)
InChIKeyDGCDUXNPHXGTRU-UHFFFAOYSA-N
MW340.43 g/mol
LogP2.67
Rot. Bonds5

About 5-(2,4-dimethylphenyl)-5-methyl-3-[3-(2-methylimidazol-1-yl)propyl]imidazolidine-2,4-dione

5-(2,4-dimethylphenyl)-5-methyl-3-[3-(2-methylimidazol-1-yl)propyl]imidazolidine-2,4-dione (PubChem CID 84593571) has the molecular formula C19H24N4O2 and a molecular weight of 340.43 g/mol. Its IUPAC name is 5-(2,4-dimethylphenyl)-5-methyl-3-[3-(2-methylimidazol-1-yl)propyl]imidazolidine-2,4-dione.

Molecular Properties

Compound Name5-(2,4-dimethylphenyl)-5-methyl-3-[3-(2-methylimidazol-1-yl)propyl]imidazolidine-2,4-dione
PubChem CID84593571
Molecular FormulaC19H24N4O2
Molecular Weight340.43 g/mol
Exact Mass340.19
IUPAC Name5-(2,4-dimethylphenyl)-5-methyl-3-[3-(2-methylimidazol-1-yl)propyl]imidazolidine-2,4-dione
SMILESCc1ccc(C2(C)NC(=O)N(CCCn3ccnc3C)C2=O)c(C)c1
InChIInChI=1S/C19H24N4O2/c1-13-6-7-16(14(2)12-13)19(4)17(24)23(18(25)21-19)10-5-9-22-11-8-20-15(22)3/h6-8,11-12H,5,9-10H2,1-4H3,(H,21,25)
InChIKeyDGCDUXNPHXGTRU-UHFFFAOYSA-N
XLogP2.67
TPSA67.23 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.43
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 5-(2,4-dimethylphenyl)-5-methyl-3-[3-(2-methylimidazol-1-yl)propyl]imidazolidine-2,4-dione?
The IUPAC name of 5-(2,4-dimethylphenyl)-5-methyl-3-[3-(2-methylimidazol-1-yl)propyl]imidazolidine-2,4-dione (CID 84593571) is 5-(2,4-dimethylphenyl)-5-methyl-3-[3-(2-methylimidazol-1-yl)propyl]imidazolidine-2,4-dione.
What is the SMILES notation for 5-(2,4-dimethylphenyl)-5-methyl-3-[3-(2-methylimidazol-1-yl)propyl]imidazolidine-2,4-dione?
The canonical SMILES for 5-(2,4-dimethylphenyl)-5-methyl-3-[3-(2-methylimidazol-1-yl)propyl]imidazolidine-2,4-dione is Cc1ccc(C2(C)NC(=O)N(CCCn3ccnc3C)C2=O)c(C)c1.
What is the InChIKey of 5-(2,4-dimethylphenyl)-5-methyl-3-[3-(2-methylimidazol-1-yl)propyl]imidazolidine-2,4-dione?
The InChIKey is DGCDUXNPHXGTRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N4O2/c1-13-6-7-16(14(2)12-13)19(4)17(24)23(18(25)21-19)10-5-9-22-11-8-20-15(22)3/h6-8,11-12H,5,9-10H2,1-4H3,(H,21,25).
What are the key properties of 5-(2,4-dimethylphenyl)-5-methyl-3-[3-(2-methylimidazol-1-yl)propyl]imidazolidine-2,4-dione?
5-(2,4-dimethylphenyl)-5-methyl-3-[3-(2-methylimidazol-1-yl)propyl]imidazolidine-2,4-dione has a molecular weight of 340.43 g/mol, XLogP of 2.67, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2,4-dimethylphenyl)-5-methyl-3-[3-(2-methylimidazol-1-yl)propyl]imidazolidine-2,4-dione is sourced from PubChem (CID 84593571), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).