(5R)-5-ethyl-3-[6-(3-methoxy-4-methylphenoxy)-3-pyridinyl]imidazolidine-2,4-dione

C18H19N3O4 — CID 53230344

IUPAC(5R)-5-ethyl-3-[6-(3-methoxy-4-methylphenoxy)-3-pyridinyl]imidazolidine-2,4-dione
SMILESCC[C@H]1NC(=O)N(c2ccc(Oc3ccc(C)c(OC)c3)nc2)C1=O
InChIInChI=1S/C18H19N3O4/c1-4-14-17(22)21(18(23)20-14)12-6-8-16(19-10-12)25-13-7-5-11(2)15(9-13)24-3/h5-10,14H,4H2,1-3H3,(H,20,23)/t14-/m1/s1
InChIKeyAMAOXEGBJHLCSF-CQSZACIVSA-N
MW341.37 g/mol
LogP3.03
Rot. Bonds5

About (5R)-5-ethyl-3-[6-(3-methoxy-4-methylphenoxy)-3-pyridinyl]imidazolidine-2,4-dione

(5R)-5-ethyl-3-[6-(3-methoxy-4-methylphenoxy)-3-pyridinyl]imidazolidine-2,4-dione (PubChem CID 53230344) has the molecular formula C18H19N3O4 and a molecular weight of 341.37 g/mol. Its IUPAC name is (5R)-5-ethyl-3-[6-(3-methoxy-4-methylphenoxy)-3-pyridinyl]imidazolidine-2,4-dione.

Molecular Properties

Compound Name(5R)-5-ethyl-3-[6-(3-methoxy-4-methylphenoxy)-3-pyridinyl]imidazolidine-2,4-dione
PubChem CID53230344
Molecular FormulaC18H19N3O4
Molecular Weight341.37 g/mol
Exact Mass341.14
IUPAC Name(5R)-5-ethyl-3-[6-(3-methoxy-4-methylphenoxy)-3-pyridinyl]imidazolidine-2,4-dione
SMILESCC[C@H]1NC(=O)N(c2ccc(Oc3ccc(C)c(OC)c3)nc2)C1=O
InChIInChI=1S/C18H19N3O4/c1-4-14-17(22)21(18(23)20-14)12-6-8-16(19-10-12)25-13-7-5-11(2)15(9-13)24-3/h5-10,14H,4H2,1-3H3,(H,20,23)/t14-/m1/s1
InChIKeyAMAOXEGBJHLCSF-CQSZACIVSA-N
XLogP3.03
TPSA80.76 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.37
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (5R)-5-ethyl-3-[6-(3-methoxy-4-methylphenoxy)-3-pyridinyl]imidazolidine-2,4-dione?
The IUPAC name of (5R)-5-ethyl-3-[6-(3-methoxy-4-methylphenoxy)-3-pyridinyl]imidazolidine-2,4-dione (CID 53230344) is (5R)-5-ethyl-3-[6-(3-methoxy-4-methylphenoxy)-3-pyridinyl]imidazolidine-2,4-dione.
What is the SMILES notation for (5R)-5-ethyl-3-[6-(3-methoxy-4-methylphenoxy)-3-pyridinyl]imidazolidine-2,4-dione?
The canonical SMILES for (5R)-5-ethyl-3-[6-(3-methoxy-4-methylphenoxy)-3-pyridinyl]imidazolidine-2,4-dione is CC[C@H]1NC(=O)N(c2ccc(Oc3ccc(C)c(OC)c3)nc2)C1=O.
What is the InChIKey of (5R)-5-ethyl-3-[6-(3-methoxy-4-methylphenoxy)-3-pyridinyl]imidazolidine-2,4-dione?
The InChIKey is AMAOXEGBJHLCSF-CQSZACIVSA-N. The full InChI is InChI=1S/C18H19N3O4/c1-4-14-17(22)21(18(23)20-14)12-6-8-16(19-10-12)25-13-7-5-11(2)15(9-13)24-3/h5-10,14H,4H2,1-3H3,(H,20,23)/t14-/m1/s1.
What are the key properties of (5R)-5-ethyl-3-[6-(3-methoxy-4-methylphenoxy)-3-pyridinyl]imidazolidine-2,4-dione?
(5R)-5-ethyl-3-[6-(3-methoxy-4-methylphenoxy)-3-pyridinyl]imidazolidine-2,4-dione has a molecular weight of 341.37 g/mol, XLogP of 3.03, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (5R)-5-ethyl-3-[6-(3-methoxy-4-methylphenoxy)-3-pyridinyl]imidazolidine-2,4-dione is sourced from PubChem (CID 53230344), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).