5-(aminomethyl)-3-methyl-5-(4-propan-2-ylphenyl)imidazolidine-2,4-dione

C14H19N3O2 — CID 82302224

IUPAC5-(aminomethyl)-3-methyl-5-(4-propan-2-ylphenyl)imidazolidine-2,4-dione
SMILESCC(C)c1ccc(C2(CN)NC(=O)N(C)C2=O)cc1
InChIInChI=1S/C14H19N3O2/c1-9(2)10-4-6-11(7-5-10)14(8-15)12(18)17(3)13(19)16-14/h4-7,9H,8,15H2,1-3H3,(H,16,19)
InChIKeyQGVRIYDJUYAPTM-UHFFFAOYSA-N
MW261.33 g/mol
LogP1.15
Rot. Bonds3

About 5-(aminomethyl)-3-methyl-5-(4-propan-2-ylphenyl)imidazolidine-2,4-dione

5-(aminomethyl)-3-methyl-5-(4-propan-2-ylphenyl)imidazolidine-2,4-dione (PubChem CID 82302224) has the molecular formula C14H19N3O2 and a molecular weight of 261.33 g/mol. Its IUPAC name is 5-(aminomethyl)-3-methyl-5-(4-propan-2-ylphenyl)imidazolidine-2,4-dione.

Molecular Properties

Compound Name5-(aminomethyl)-3-methyl-5-(4-propan-2-ylphenyl)imidazolidine-2,4-dione
PubChem CID82302224
Molecular FormulaC14H19N3O2
Molecular Weight261.33 g/mol
Exact Mass261.15
IUPAC Name5-(aminomethyl)-3-methyl-5-(4-propan-2-ylphenyl)imidazolidine-2,4-dione
SMILESCC(C)c1ccc(C2(CN)NC(=O)N(C)C2=O)cc1
InChIInChI=1S/C14H19N3O2/c1-9(2)10-4-6-11(7-5-10)14(8-15)12(18)17(3)13(19)16-14/h4-7,9H,8,15H2,1-3H3,(H,16,19)
InChIKeyQGVRIYDJUYAPTM-UHFFFAOYSA-N
XLogP1.15
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.33
LogP ≤ 51.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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-(aminomethyl)-3-methyl-5-(4-propan-2-ylphenyl)imidazolidine-2,4-dione?
The IUPAC name of 5-(aminomethyl)-3-methyl-5-(4-propan-2-ylphenyl)imidazolidine-2,4-dione (CID 82302224) is 5-(aminomethyl)-3-methyl-5-(4-propan-2-ylphenyl)imidazolidine-2,4-dione.
What is the SMILES notation for 5-(aminomethyl)-3-methyl-5-(4-propan-2-ylphenyl)imidazolidine-2,4-dione?
The canonical SMILES for 5-(aminomethyl)-3-methyl-5-(4-propan-2-ylphenyl)imidazolidine-2,4-dione is CC(C)c1ccc(C2(CN)NC(=O)N(C)C2=O)cc1.
What is the InChIKey of 5-(aminomethyl)-3-methyl-5-(4-propan-2-ylphenyl)imidazolidine-2,4-dione?
The InChIKey is QGVRIYDJUYAPTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O2/c1-9(2)10-4-6-11(7-5-10)14(8-15)12(18)17(3)13(19)16-14/h4-7,9H,8,15H2,1-3H3,(H,16,19).
What are the key properties of 5-(aminomethyl)-3-methyl-5-(4-propan-2-ylphenyl)imidazolidine-2,4-dione?
5-(aminomethyl)-3-methyl-5-(4-propan-2-ylphenyl)imidazolidine-2,4-dione has a molecular weight of 261.33 g/mol, XLogP of 1.15, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(aminomethyl)-3-methyl-5-(4-propan-2-ylphenyl)imidazolidine-2,4-dione is sourced from PubChem (CID 82302224), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).