1-[(Z)-(3-ethoxy-4-phenylmethoxyphenyl)methylideneamino]imidazolidine-2,4-dione

C19H19N3O4 — CID 9351065

IUPAC1-[(Z)-(3-ethoxy-4-phenylmethoxyphenyl)methylideneamino]imidazolidine-2,4-dione
SMILESCCOc1cc(/C=N\N2CC(=O)NC2=O)ccc1OCc1ccccc1
InChIInChI=1S/C19H19N3O4/c1-2-25-17-10-15(11-20-22-12-18(23)21-19(22)24)8-9-16(17)26-13-14-6-4-3-5-7-14/h3-11H,2,12-13H2,1H3,(H,21,23,24)/b20-11-
InChIKeyXDKKBOPGXFKSCW-JAIQZWGSSA-N
MW353.38 g/mol
LogP2.55
Rot. Bonds7

About 1-[(Z)-(3-ethoxy-4-phenylmethoxyphenyl)methylideneamino]imidazolidine-2,4-dione

1-[(Z)-(3-ethoxy-4-phenylmethoxyphenyl)methylideneamino]imidazolidine-2,4-dione (PubChem CID 9351065) has the molecular formula C19H19N3O4 and a molecular weight of 353.38 g/mol. Its IUPAC name is 1-[(Z)-(3-ethoxy-4-phenylmethoxyphenyl)methylideneamino]imidazolidine-2,4-dione.

Molecular Properties

Compound Name1-[(Z)-(3-ethoxy-4-phenylmethoxyphenyl)methylideneamino]imidazolidine-2,4-dione
PubChem CID9351065
Molecular FormulaC19H19N3O4
Molecular Weight353.38 g/mol
Exact Mass353.14
IUPAC Name1-[(Z)-(3-ethoxy-4-phenylmethoxyphenyl)methylideneamino]imidazolidine-2,4-dione
SMILESCCOc1cc(/C=N\N2CC(=O)NC2=O)ccc1OCc1ccccc1
InChIInChI=1S/C19H19N3O4/c1-2-25-17-10-15(11-20-22-12-18(23)21-19(22)24)8-9-16(17)26-13-14-6-4-3-5-7-14/h3-11H,2,12-13H2,1H3,(H,21,23,24)/b20-11-
InChIKeyXDKKBOPGXFKSCW-JAIQZWGSSA-N
XLogP2.55
TPSA80.23 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.38
LogP ≤ 52.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydantoin', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

(1S,2S,6R,7R,8S,10R)-4-[(Z)-(3-ethoxy-4-phenylmethoxyphenyl)methylideneamino]-4-azatetracyclo[5.3.2.02,6.08,10]dodec-11-ene-3,5-dione
CID 22525548
1-[(Z)-(3-methoxy-4-prop-2-enoxyphenyl)methylideneamino]imidazolidine-2,4-dione
CID 9351018
1-[(Z)-[4-[2-(2-chlorophenoxy)ethoxy]-3-methoxyphenyl]methylideneamino]imidazolidine-2,4-dione
CID 9350990
5-[(3-ethoxy-4-phenylmethoxyphenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
CID 2848928
4-[(Z)-(3-ethoxy-4-phenylmethoxyphenyl)methylideneamino]-3-phenyl-1H-1,2,4-triazole-5-thione
CID 110520280
N-[(5Z)-5-[(3-ethoxy-4-phenylmethoxyphenyl)methylidene]-4-oxo-1,3-thiazolidin-2-ylidene]benzamide
CID 137126720
4-[(Z)-(3-ethoxy-4-phenylmethoxyphenyl)methylideneamino]-3-(2-phenylethyl)-1H-1,2,4-triazole-5-thione
CID 110519938
(5E)-3-benzyl-5-[(3-ethoxy-4-phenylmethoxyphenyl)methylidene]imidazolidine-2,4-dione
CID 126212321
1-ethoxy-2-phenylmethoxy-4-[(E)-prop-1-enyl]benzene
CID 90367929
(3aR)-3a-[(E)-2-(3-ethoxy-4-phenylmethoxyphenyl)ethenyl]-4,4-dimethyl-1,3-dihydroimidazo[1,2-a]indol-2-one
CID 40872738
(E)-N-(3-benzylsulfanyl-1,2,4-triazol-4-yl)-1-(3-ethoxy-4-phenylmethoxyphenyl)methanimine
CID 22693936
(4Z)-4-[(3-ethoxy-4-phenylmethoxyphenyl)methylidene]-1-phenylpyrazolidine-3,5-dione
CID 126408189

Frequently Asked Questions

What is the IUPAC name of 1-[(Z)-(3-ethoxy-4-phenylmethoxyphenyl)methylideneamino]imidazolidine-2,4-dione?
The IUPAC name of 1-[(Z)-(3-ethoxy-4-phenylmethoxyphenyl)methylideneamino]imidazolidine-2,4-dione (CID 9351065) is 1-[(Z)-(3-ethoxy-4-phenylmethoxyphenyl)methylideneamino]imidazolidine-2,4-dione.
What is the SMILES notation for 1-[(Z)-(3-ethoxy-4-phenylmethoxyphenyl)methylideneamino]imidazolidine-2,4-dione?
The canonical SMILES for 1-[(Z)-(3-ethoxy-4-phenylmethoxyphenyl)methylideneamino]imidazolidine-2,4-dione is CCOc1cc(/C=N\N2CC(=O)NC2=O)ccc1OCc1ccccc1.
What is the InChIKey of 1-[(Z)-(3-ethoxy-4-phenylmethoxyphenyl)methylideneamino]imidazolidine-2,4-dione?
The InChIKey is XDKKBOPGXFKSCW-JAIQZWGSSA-N. The full InChI is InChI=1S/C19H19N3O4/c1-2-25-17-10-15(11-20-22-12-18(23)21-19(22)24)8-9-16(17)26-13-14-6-4-3-5-7-14/h3-11H,2,12-13H2,1H3,(H,21,23,24)/b20-11-.
What are the key properties of 1-[(Z)-(3-ethoxy-4-phenylmethoxyphenyl)methylideneamino]imidazolidine-2,4-dione?
1-[(Z)-(3-ethoxy-4-phenylmethoxyphenyl)methylideneamino]imidazolidine-2,4-dione has a molecular weight of 353.38 g/mol, XLogP of 2.55, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(Z)-(3-ethoxy-4-phenylmethoxyphenyl)methylideneamino]imidazolidine-2,4-dione is sourced from PubChem (CID 9351065), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).