5-(aminomethyl)-5-(2,3,5,6-tetramethylphenyl)imidazolidine-2,4-dione

C14H19N3O2 — CID 82302234

IUPAC5-(aminomethyl)-5-(2,3,5,6-tetramethylphenyl)imidazolidine-2,4-dione
SMILESCc1cc(C)c(C)c(C2(CN)NC(=O)NC2=O)c1C
InChIInChI=1S/C14H19N3O2/c1-7-5-8(2)10(4)11(9(7)3)14(6-15)12(18)16-13(19)17-14/h5H,6,15H2,1-4H3,(H2,16,17,18,19)
InChIKeyLQXAYWNZRKRDLF-UHFFFAOYSA-N
MW261.32 g/mol
LogP0.91
Rot. Bonds2

About 5-(aminomethyl)-5-(2,3,5,6-tetramethylphenyl)imidazolidine-2,4-dione

5-(aminomethyl)-5-(2,3,5,6-tetramethylphenyl)imidazolidine-2,4-dione (PubChem CID 82302234) has the molecular formula C14H19N3O2 and a molecular weight of 261.32 g/mol. Its IUPAC name is 5-(aminomethyl)-5-(2,3,5,6-tetramethylphenyl)imidazolidine-2,4-dione.

Molecular Properties

Compound Name5-(aminomethyl)-5-(2,3,5,6-tetramethylphenyl)imidazolidine-2,4-dione
PubChem CID82302234
Molecular FormulaC14H19N3O2
Molecular Weight261.32 g/mol
Exact Mass261.15
IUPAC Name5-(aminomethyl)-5-(2,3,5,6-tetramethylphenyl)imidazolidine-2,4-dione
SMILESCc1cc(C)c(C)c(C2(CN)NC(=O)NC2=O)c1C
InChIInChI=1S/C14H19N3O2/c1-7-5-8(2)10(4)11(9(7)3)14(6-15)12(18)16-13(19)17-14/h5H,6,15H2,1-4H3,(H2,16,17,18,19)
InChIKeyLQXAYWNZRKRDLF-UHFFFAOYSA-N
XLogP0.91
TPSA84.22 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.32
LogP ≤ 50.91
H-Bond Donors ≤ 53
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)-5-(2,3,5,6-tetramethylphenyl)imidazolidine-2,4-dione?
The IUPAC name of 5-(aminomethyl)-5-(2,3,5,6-tetramethylphenyl)imidazolidine-2,4-dione (CID 82302234) is 5-(aminomethyl)-5-(2,3,5,6-tetramethylphenyl)imidazolidine-2,4-dione.
What is the SMILES notation for 5-(aminomethyl)-5-(2,3,5,6-tetramethylphenyl)imidazolidine-2,4-dione?
The canonical SMILES for 5-(aminomethyl)-5-(2,3,5,6-tetramethylphenyl)imidazolidine-2,4-dione is Cc1cc(C)c(C)c(C2(CN)NC(=O)NC2=O)c1C.
What is the InChIKey of 5-(aminomethyl)-5-(2,3,5,6-tetramethylphenyl)imidazolidine-2,4-dione?
The InChIKey is LQXAYWNZRKRDLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O2/c1-7-5-8(2)10(4)11(9(7)3)14(6-15)12(18)16-13(19)17-14/h5H,6,15H2,1-4H3,(H2,16,17,18,19).
What are the key properties of 5-(aminomethyl)-5-(2,3,5,6-tetramethylphenyl)imidazolidine-2,4-dione?
5-(aminomethyl)-5-(2,3,5,6-tetramethylphenyl)imidazolidine-2,4-dione has a molecular weight of 261.32 g/mol, XLogP of 0.91, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(aminomethyl)-5-(2,3,5,6-tetramethylphenyl)imidazolidine-2,4-dione is sourced from PubChem (CID 82302234), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).