3-amino-5-methyl-5-phenylimidazolidine-2,4-dione

C10H11N3O2 — CID 4685120

IUPAC3-amino-5-methyl-5-phenylimidazolidine-2,4-dione
SMILESCC1(c2ccccc2)NC(=O)N(N)C1=O
InChIInChI=1S/C10H11N3O2/c1-10(7-5-3-2-4-6-7)8(14)13(11)9(15)12-10/h2-6H,11H2,1H3,(H,12,15)
InChIKeyPTVDNZQYPWTLBQ-UHFFFAOYSA-N
MW205.22 g/mol
LogP0.33
Rot. Bonds1

About 3-amino-5-methyl-5-phenylimidazolidine-2,4-dione

3-amino-5-methyl-5-phenylimidazolidine-2,4-dione (PubChem CID 4685120) has the molecular formula C10H11N3O2 and a molecular weight of 205.22 g/mol. Its IUPAC name is 3-amino-5-methyl-5-phenylimidazolidine-2,4-dione.

Molecular Properties

Compound Name3-amino-5-methyl-5-phenylimidazolidine-2,4-dione
PubChem CID4685120
Molecular FormulaC10H11N3O2
Molecular Weight205.22 g/mol
Exact Mass205.09
IUPAC Name3-amino-5-methyl-5-phenylimidazolidine-2,4-dione
SMILESCC1(c2ccccc2)NC(=O)N(N)C1=O
InChIInChI=1S/C10H11N3O2/c1-10(7-5-3-2-4-6-7)8(14)13(11)9(15)12-10/h2-6H,11H2,1H3,(H,12,15)
InChIKeyPTVDNZQYPWTLBQ-UHFFFAOYSA-N
XLogP0.33
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.22
LogP ≤ 50.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 3-amino-5-methyl-5-phenylimidazolidine-2,4-dione?
The IUPAC name of 3-amino-5-methyl-5-phenylimidazolidine-2,4-dione (CID 4685120) is 3-amino-5-methyl-5-phenylimidazolidine-2,4-dione.
What is the SMILES notation for 3-amino-5-methyl-5-phenylimidazolidine-2,4-dione?
The canonical SMILES for 3-amino-5-methyl-5-phenylimidazolidine-2,4-dione is CC1(c2ccccc2)NC(=O)N(N)C1=O.
What is the InChIKey of 3-amino-5-methyl-5-phenylimidazolidine-2,4-dione?
The InChIKey is PTVDNZQYPWTLBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N3O2/c1-10(7-5-3-2-4-6-7)8(14)13(11)9(15)12-10/h2-6H,11H2,1H3,(H,12,15).
What are the key properties of 3-amino-5-methyl-5-phenylimidazolidine-2,4-dione?
3-amino-5-methyl-5-phenylimidazolidine-2,4-dione has a molecular weight of 205.22 g/mol, XLogP of 0.33, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-5-methyl-5-phenylimidazolidine-2,4-dione is sourced from PubChem (CID 4685120), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).