5,5-bis(4-methoxyphenyl)-3-(2-morpholin-4-yl-2-oxoethyl)imidazolidine-2,4-dione

C23H25N3O6 — CID 4883829

IUPAC5,5-bis(4-methoxyphenyl)-3-(2-morpholin-4-yl-2-oxoethyl)imidazolidine-2,4-dione
SMILESCOc1ccc(C2(c3ccc(OC)cc3)NC(=O)N(CC(=O)N3CCOCC3)C2=O)cc1
InChIInChI=1S/C23H25N3O6/c1-30-18-7-3-16(4-8-18)23(17-5-9-19(31-2)10-6-17)21(28)26(22(29)24-23)15-20(27)25-11-13-32-14-12-25/h3-10H,11-15H2,1-2H3,(H,24,29)
InChIKeyZKZLUTJXPWOQOU-UHFFFAOYSA-N
MW439.47 g/mol
LogP1.36
Rot. Bonds6

About 5,5-bis(4-methoxyphenyl)-3-(2-morpholin-4-yl-2-oxoethyl)imidazolidine-2,4-dione

5,5-bis(4-methoxyphenyl)-3-(2-morpholin-4-yl-2-oxoethyl)imidazolidine-2,4-dione (PubChem CID 4883829) has the molecular formula C23H25N3O6 and a molecular weight of 439.47 g/mol. Its IUPAC name is 5,5-bis(4-methoxyphenyl)-3-(2-morpholin-4-yl-2-oxoethyl)imidazolidine-2,4-dione.

Molecular Properties

Compound Name5,5-bis(4-methoxyphenyl)-3-(2-morpholin-4-yl-2-oxoethyl)imidazolidine-2,4-dione
PubChem CID4883829
Molecular FormulaC23H25N3O6
Molecular Weight439.47 g/mol
Exact Mass439.17
IUPAC Name5,5-bis(4-methoxyphenyl)-3-(2-morpholin-4-yl-2-oxoethyl)imidazolidine-2,4-dione
SMILESCOc1ccc(C2(c3ccc(OC)cc3)NC(=O)N(CC(=O)N3CCOCC3)C2=O)cc1
InChIInChI=1S/C23H25N3O6/c1-30-18-7-3-16(4-8-18)23(17-5-9-19(31-2)10-6-17)21(28)26(22(29)24-23)15-20(27)25-11-13-32-14-12-25/h3-10H,11-15H2,1-2H3,(H,24,29)
InChIKeyZKZLUTJXPWOQOU-UHFFFAOYSA-N
XLogP1.36
TPSA97.41 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500439.47
LogP ≤ 51.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 5,5-bis(4-methoxyphenyl)-3-(2-morpholin-4-yl-2-oxoethyl)imidazolidine-2,4-dione?
The IUPAC name of 5,5-bis(4-methoxyphenyl)-3-(2-morpholin-4-yl-2-oxoethyl)imidazolidine-2,4-dione (CID 4883829) is 5,5-bis(4-methoxyphenyl)-3-(2-morpholin-4-yl-2-oxoethyl)imidazolidine-2,4-dione.
What is the SMILES notation for 5,5-bis(4-methoxyphenyl)-3-(2-morpholin-4-yl-2-oxoethyl)imidazolidine-2,4-dione?
The canonical SMILES for 5,5-bis(4-methoxyphenyl)-3-(2-morpholin-4-yl-2-oxoethyl)imidazolidine-2,4-dione is COc1ccc(C2(c3ccc(OC)cc3)NC(=O)N(CC(=O)N3CCOCC3)C2=O)cc1.
What is the InChIKey of 5,5-bis(4-methoxyphenyl)-3-(2-morpholin-4-yl-2-oxoethyl)imidazolidine-2,4-dione?
The InChIKey is ZKZLUTJXPWOQOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25N3O6/c1-30-18-7-3-16(4-8-18)23(17-5-9-19(31-2)10-6-17)21(28)26(22(29)24-23)15-20(27)25-11-13-32-14-12-25/h3-10H,11-15H2,1-2H3,(H,24,29).
What are the key properties of 5,5-bis(4-methoxyphenyl)-3-(2-morpholin-4-yl-2-oxoethyl)imidazolidine-2,4-dione?
5,5-bis(4-methoxyphenyl)-3-(2-morpholin-4-yl-2-oxoethyl)imidazolidine-2,4-dione has a molecular weight of 439.47 g/mol, XLogP of 1.36, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5,5-bis(4-methoxyphenyl)-3-(2-morpholin-4-yl-2-oxoethyl)imidazolidine-2,4-dione is sourced from PubChem (CID 4883829), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).