1-[(Z)-(3-methoxy-4-prop-2-enoxyphenyl)methylideneamino]imidazolidine-2,4-dione

C14H15N3O4 — CID 9351018

IUPAC1-[(Z)-(3-methoxy-4-prop-2-enoxyphenyl)methylideneamino]imidazolidine-2,4-dione
SMILESC=CCOc1ccc(/C=N\N2CC(=O)NC2=O)cc1OC
InChIInChI=1S/C14H15N3O4/c1-3-6-21-11-5-4-10(7-12(11)20-2)8-15-17-9-13(18)16-14(17)19/h3-5,7-8H,1,6,9H2,2H3,(H,16,18,19)/b15-8-
InChIKeyYNASYUPVUCOQAW-NVNXTCNLSA-N
MW289.29 g/mol
LogP1.15
Rot. Bonds6

About 1-[(Z)-(3-methoxy-4-prop-2-enoxyphenyl)methylideneamino]imidazolidine-2,4-dione

1-[(Z)-(3-methoxy-4-prop-2-enoxyphenyl)methylideneamino]imidazolidine-2,4-dione (PubChem CID 9351018) has the molecular formula C14H15N3O4 and a molecular weight of 289.29 g/mol. Its IUPAC name is 1-[(Z)-(3-methoxy-4-prop-2-enoxyphenyl)methylideneamino]imidazolidine-2,4-dione.

Molecular Properties

Compound Name1-[(Z)-(3-methoxy-4-prop-2-enoxyphenyl)methylideneamino]imidazolidine-2,4-dione
PubChem CID9351018
Molecular FormulaC14H15N3O4
Molecular Weight289.29 g/mol
Exact Mass289.11
IUPAC Name1-[(Z)-(3-methoxy-4-prop-2-enoxyphenyl)methylideneamino]imidazolidine-2,4-dione
SMILESC=CCOc1ccc(/C=N\N2CC(=O)NC2=O)cc1OC
InChIInChI=1S/C14H15N3O4/c1-3-6-21-11-5-4-10(7-12(11)20-2)8-15-17-9-13(18)16-14(17)19/h3-5,7-8H,1,6,9H2,2H3,(H,16,18,19)/b15-8-
InChIKeyYNASYUPVUCOQAW-NVNXTCNLSA-N
XLogP1.15
TPSA80.23 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.29
LogP ≤ 51.15
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'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

1-[(Z)-[4-[2-(2-chlorophenoxy)ethoxy]-3-methoxyphenyl]methylideneamino]imidazolidine-2,4-dione
CID 9350990
2-[(3-methoxy-4-prop-2-enoxyphenyl)methylidenehydrazinylidene]-1,3-thiazolidin-4-one
CID 168576322
1-[(Z)-(3-ethoxy-4-phenylmethoxyphenyl)methylideneamino]imidazolidine-2,4-dione
CID 9351065
4-[(E)-(3-methoxy-4-prop-2-enoxyphenyl)methylideneamino]-6-methyl-3-sulfanylidene-2H-1,2,4-triazin-5-one
CID 6894399
3-[(3-methoxy-4-prop-2-enoxyphenyl)methylideneamino]-1H-quinazoline-2,4-dione
CID 4285543
4-fluoro-N-[(Z)-(3-methoxy-4-prop-2-enoxyphenyl)methylideneamino]aniline
CID 9076506
2-methoxy-4-[2-[4-[4-[2-(3-methoxy-4-prop-2-enoxyphenyl)ethenyl]phenyl]phenyl]ethenyl]-1-prop-2-enoxybenzene
CID 54438729
5-[(3-methoxy-4-prop-2-enoxyphenyl)methylidene]-1-prop-2-enyl-1,3-diazinane-2,4,6-trione
CID 2865683
N-[(E)-(3-methoxy-4-prop-2-enoxyphenyl)methylideneamino]-2H-tetrazol-5-amine
CID 19617455
methyl (2E)-2-[(2Z)-2-[(3-methoxy-4-prop-2-enoxyphenyl)methylidenehydrazinylidene]-4-oxo-1,3-thiazolidin-5-ylidene]acetate
CID 172925664
(5E)-2-cyclopentylimino-5-[(3-methoxy-4-prop-2-enoxyphenyl)methylidene]-1,3-thiazolidin-4-one
CID 167864296
2-hydroxy-N-[(3-methoxy-4-prop-2-enoxyphenyl)methylideneamino]propanamide
CID 3247960

Frequently Asked Questions

What is the IUPAC name of 1-[(Z)-(3-methoxy-4-prop-2-enoxyphenyl)methylideneamino]imidazolidine-2,4-dione?
The IUPAC name of 1-[(Z)-(3-methoxy-4-prop-2-enoxyphenyl)methylideneamino]imidazolidine-2,4-dione (CID 9351018) is 1-[(Z)-(3-methoxy-4-prop-2-enoxyphenyl)methylideneamino]imidazolidine-2,4-dione.
What is the SMILES notation for 1-[(Z)-(3-methoxy-4-prop-2-enoxyphenyl)methylideneamino]imidazolidine-2,4-dione?
The canonical SMILES for 1-[(Z)-(3-methoxy-4-prop-2-enoxyphenyl)methylideneamino]imidazolidine-2,4-dione is C=CCOc1ccc(/C=N\N2CC(=O)NC2=O)cc1OC.
What is the InChIKey of 1-[(Z)-(3-methoxy-4-prop-2-enoxyphenyl)methylideneamino]imidazolidine-2,4-dione?
The InChIKey is YNASYUPVUCOQAW-NVNXTCNLSA-N. The full InChI is InChI=1S/C14H15N3O4/c1-3-6-21-11-5-4-10(7-12(11)20-2)8-15-17-9-13(18)16-14(17)19/h3-5,7-8H,1,6,9H2,2H3,(H,16,18,19)/b15-8-.
What are the key properties of 1-[(Z)-(3-methoxy-4-prop-2-enoxyphenyl)methylideneamino]imidazolidine-2,4-dione?
1-[(Z)-(3-methoxy-4-prop-2-enoxyphenyl)methylideneamino]imidazolidine-2,4-dione has a molecular weight of 289.29 g/mol, XLogP of 1.15, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(Z)-(3-methoxy-4-prop-2-enoxyphenyl)methylideneamino]imidazolidine-2,4-dione is sourced from PubChem (CID 9351018), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).