(5Z)-5-(dimethylaminomethylidene)-1-(4-ethoxyphenyl)-3-ethylimidazolidine-2,4-dione

C16H21N3O3 — CID 20526811

IUPAC(5Z)-5-(dimethylaminomethylidene)-1-(4-ethoxyphenyl)-3-ethylimidazolidine-2,4-dione
SMILESCCOc1ccc(N2C(=O)N(CC)C(=O)/C2=C/N(C)C)cc1
InChIInChI=1S/C16H21N3O3/c1-5-18-15(20)14(11-17(3)4)19(16(18)21)12-7-9-13(10-8-12)22-6-2/h7-11H,5-6H2,1-4H3/b14-11-
InChIKeyMDPAACFPNCFEPP-KAMYIIQDSA-N
MW303.36 g/mol
LogP2.28
Rot. Bonds5

About (5Z)-5-(dimethylaminomethylidene)-1-(4-ethoxyphenyl)-3-ethylimidazolidine-2,4-dione

(5Z)-5-(dimethylaminomethylidene)-1-(4-ethoxyphenyl)-3-ethylimidazolidine-2,4-dione (PubChem CID 20526811) has the molecular formula C16H21N3O3 and a molecular weight of 303.36 g/mol. Its IUPAC name is (5Z)-5-(dimethylaminomethylidene)-1-(4-ethoxyphenyl)-3-ethylimidazolidine-2,4-dione.

Molecular Properties

Compound Name(5Z)-5-(dimethylaminomethylidene)-1-(4-ethoxyphenyl)-3-ethylimidazolidine-2,4-dione
PubChem CID20526811
Molecular FormulaC16H21N3O3
Molecular Weight303.36 g/mol
Exact Mass303.16
IUPAC Name(5Z)-5-(dimethylaminomethylidene)-1-(4-ethoxyphenyl)-3-ethylimidazolidine-2,4-dione
SMILESCCOc1ccc(N2C(=O)N(CC)C(=O)/C2=C/N(C)C)cc1
InChIInChI=1S/C16H21N3O3/c1-5-18-15(20)14(11-17(3)4)19(16(18)21)12-7-9-13(10-8-12)22-6-2/h7-11H,5-6H2,1-4H3/b14-11-
InChIKeyMDPAACFPNCFEPP-KAMYIIQDSA-N
XLogP2.28
TPSA53.09 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.36
LogP ≤ 52.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydantoin', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

Analyze (5Z)-5-(dimethylaminomethylidene)-1-(4-ethoxyphenyl)-3-ethylimidazolidine-2,4-dione with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1,3-bis(4-chlorophenyl)-5-[(4-ethoxyphenyl)methylidene]-1,3-diazinane-2,4,6-trione
CID 3563074
(5E)-3-(4-ethoxyphenyl)-5-[3-(4-ethoxyphenyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
CID 6388432
5-[2-(dimethylamino)ethyl]-1-(4-ethoxyphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione
CID 3033752
6-(4-ethoxyphenyl)-3,7a-dihydro-1H-imidazo[1,5-c][1,3]thiazole-5,7-dione
CID 14368511
2-(4-ethoxyphenyl)-3a,4,7,7a-tetrahydroisoindole-1,3-dione
CID 2853944
(3aR,7aR)-2-(4-ethoxyphenyl)-3a,4,7,7a-tetrahydroisoindole-1,3-dione
CID 872279
(3aS,7aR)-2-(4-ethoxyphenyl)-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione
CID 7032574
3-(4-ethoxyphenyl)-5-[(4-methoxyphenyl)methylidene]-1-methyl-2-sulfanylideneimidazolidin-4-one
CID 1312699
(5E)-1-(4-chlorophenyl)-5-[(4-ethoxyphenyl)methylidene]-1,3-diazinane-2,4,6-trione
CID 1363676
2-(4-ethoxyphenyl)-3aH-imidazo[1,5-a]quinoxaline-1,3-dione
CID 173284470
[(3R)-1-(4-ethoxyphenyl)-2,5-dioxopyrrolidin-3-yl]azanium
CID 7198359
5-[(3,4-dichlorophenyl)methylidene]-3-(4-ethoxyphenyl)-2-sulfanylideneimidazolidin-4-one
CID 5112343

Frequently Asked Questions

What is the IUPAC name of (5Z)-5-(dimethylaminomethylidene)-1-(4-ethoxyphenyl)-3-ethylimidazolidine-2,4-dione?
The IUPAC name of (5Z)-5-(dimethylaminomethylidene)-1-(4-ethoxyphenyl)-3-ethylimidazolidine-2,4-dione (CID 20526811) is (5Z)-5-(dimethylaminomethylidene)-1-(4-ethoxyphenyl)-3-ethylimidazolidine-2,4-dione.
What is the SMILES notation for (5Z)-5-(dimethylaminomethylidene)-1-(4-ethoxyphenyl)-3-ethylimidazolidine-2,4-dione?
The canonical SMILES for (5Z)-5-(dimethylaminomethylidene)-1-(4-ethoxyphenyl)-3-ethylimidazolidine-2,4-dione is CCOc1ccc(N2C(=O)N(CC)C(=O)/C2=C/N(C)C)cc1.
What is the InChIKey of (5Z)-5-(dimethylaminomethylidene)-1-(4-ethoxyphenyl)-3-ethylimidazolidine-2,4-dione?
The InChIKey is MDPAACFPNCFEPP-KAMYIIQDSA-N. The full InChI is InChI=1S/C16H21N3O3/c1-5-18-15(20)14(11-17(3)4)19(16(18)21)12-7-9-13(10-8-12)22-6-2/h7-11H,5-6H2,1-4H3/b14-11-.
What are the key properties of (5Z)-5-(dimethylaminomethylidene)-1-(4-ethoxyphenyl)-3-ethylimidazolidine-2,4-dione?
(5Z)-5-(dimethylaminomethylidene)-1-(4-ethoxyphenyl)-3-ethylimidazolidine-2,4-dione has a molecular weight of 303.36 g/mol, XLogP of 2.28, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (5Z)-5-(dimethylaminomethylidene)-1-(4-ethoxyphenyl)-3-ethylimidazolidine-2,4-dione is sourced from PubChem (CID 20526811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).