5-(4-chlorophenyl)-5-methyl-3-(morpholin-4-ylmethyl)imidazolidine-2,4-dione

C15H18ClN3O3 — CID 4883031

IUPAC5-(4-chlorophenyl)-5-methyl-3-(morpholin-4-ylmethyl)imidazolidine-2,4-dione
SMILESCC1(c2ccc(Cl)cc2)NC(=O)N(CN2CCOCC2)C1=O
InChIInChI=1S/C15H18ClN3O3/c1-15(11-2-4-12(16)5-3-11)13(20)19(14(21)17-15)10-18-6-8-22-9-7-18/h2-5H,6-10H2,1H3,(H,17,21)
InChIKeyKEBHIQKJXPZASJ-UHFFFAOYSA-N
MW323.78 g/mol
LogP1.40
Rot. Bonds3

About 5-(4-chlorophenyl)-5-methyl-3-(morpholin-4-ylmethyl)imidazolidine-2,4-dione

5-(4-chlorophenyl)-5-methyl-3-(morpholin-4-ylmethyl)imidazolidine-2,4-dione (PubChem CID 4883031) has the molecular formula C15H18ClN3O3 and a molecular weight of 323.78 g/mol. Its IUPAC name is 5-(4-chlorophenyl)-5-methyl-3-(morpholin-4-ylmethyl)imidazolidine-2,4-dione.

Molecular Properties

Compound Name5-(4-chlorophenyl)-5-methyl-3-(morpholin-4-ylmethyl)imidazolidine-2,4-dione
PubChem CID4883031
Molecular FormulaC15H18ClN3O3
Molecular Weight323.78 g/mol
Exact Mass323.10
IUPAC Name5-(4-chlorophenyl)-5-methyl-3-(morpholin-4-ylmethyl)imidazolidine-2,4-dione
SMILESCC1(c2ccc(Cl)cc2)NC(=O)N(CN2CCOCC2)C1=O
InChIInChI=1S/C15H18ClN3O3/c1-15(11-2-4-12(16)5-3-11)13(20)19(14(21)17-15)10-18-6-8-22-9-7-18/h2-5H,6-10H2,1H3,(H,17,21)
InChIKeyKEBHIQKJXPZASJ-UHFFFAOYSA-N
XLogP1.40
TPSA61.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.78
LogP ≤ 51.40
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-(4-chlorophenyl)-5-methyl-3-(morpholin-4-ylmethyl)imidazolidine-2,4-dione?
The IUPAC name of 5-(4-chlorophenyl)-5-methyl-3-(morpholin-4-ylmethyl)imidazolidine-2,4-dione (CID 4883031) is 5-(4-chlorophenyl)-5-methyl-3-(morpholin-4-ylmethyl)imidazolidine-2,4-dione.
What is the SMILES notation for 5-(4-chlorophenyl)-5-methyl-3-(morpholin-4-ylmethyl)imidazolidine-2,4-dione?
The canonical SMILES for 5-(4-chlorophenyl)-5-methyl-3-(morpholin-4-ylmethyl)imidazolidine-2,4-dione is CC1(c2ccc(Cl)cc2)NC(=O)N(CN2CCOCC2)C1=O.
What is the InChIKey of 5-(4-chlorophenyl)-5-methyl-3-(morpholin-4-ylmethyl)imidazolidine-2,4-dione?
The InChIKey is KEBHIQKJXPZASJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18ClN3O3/c1-15(11-2-4-12(16)5-3-11)13(20)19(14(21)17-15)10-18-6-8-22-9-7-18/h2-5H,6-10H2,1H3,(H,17,21).
What are the key properties of 5-(4-chlorophenyl)-5-methyl-3-(morpholin-4-ylmethyl)imidazolidine-2,4-dione?
5-(4-chlorophenyl)-5-methyl-3-(morpholin-4-ylmethyl)imidazolidine-2,4-dione has a molecular weight of 323.78 g/mol, XLogP of 1.40, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-chlorophenyl)-5-methyl-3-(morpholin-4-ylmethyl)imidazolidine-2,4-dione is sourced from PubChem (CID 4883031), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).