3-(3-aminopropyl)-5-ethyl-5-(4-methoxy-3-methylphenyl)imidazolidine-2,4-dione

C16H23N3O3 — CID 82147903

IUPAC3-(3-aminopropyl)-5-ethyl-5-(4-methoxy-3-methylphenyl)imidazolidine-2,4-dione
SMILESCCC1(c2ccc(OC)c(C)c2)NC(=O)N(CCCN)C1=O
InChIInChI=1S/C16H23N3O3/c1-4-16(12-6-7-13(22-3)11(2)10-12)14(20)19(9-5-8-17)15(21)18-16/h6-7,10H,4-5,8-9,17H2,1-3H3,(H,18,21)
InChIKeyYYWSPOSFWFKXGU-UHFFFAOYSA-N
MW305.38 g/mol
LogP1.51
Rot. Bonds6

About 3-(3-aminopropyl)-5-ethyl-5-(4-methoxy-3-methylphenyl)imidazolidine-2,4-dione

3-(3-aminopropyl)-5-ethyl-5-(4-methoxy-3-methylphenyl)imidazolidine-2,4-dione (PubChem CID 82147903) has the molecular formula C16H23N3O3 and a molecular weight of 305.38 g/mol. Its IUPAC name is 3-(3-aminopropyl)-5-ethyl-5-(4-methoxy-3-methylphenyl)imidazolidine-2,4-dione.

Molecular Properties

Compound Name3-(3-aminopropyl)-5-ethyl-5-(4-methoxy-3-methylphenyl)imidazolidine-2,4-dione
PubChem CID82147903
Molecular FormulaC16H23N3O3
Molecular Weight305.38 g/mol
Exact Mass305.17
IUPAC Name3-(3-aminopropyl)-5-ethyl-5-(4-methoxy-3-methylphenyl)imidazolidine-2,4-dione
SMILESCCC1(c2ccc(OC)c(C)c2)NC(=O)N(CCCN)C1=O
InChIInChI=1S/C16H23N3O3/c1-4-16(12-6-7-13(22-3)11(2)10-12)14(20)19(9-5-8-17)15(21)18-16/h6-7,10H,4-5,8-9,17H2,1-3H3,(H,18,21)
InChIKeyYYWSPOSFWFKXGU-UHFFFAOYSA-N
XLogP1.51
TPSA84.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.38
LogP ≤ 51.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 3-(3-aminopropyl)-5-ethyl-5-(4-methoxy-3-methylphenyl)imidazolidine-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

3-(2-aminoethyl)-5-(3,4-dimethylphenyl)-5-ethylimidazolidine-2,4-dione
CID 82147813
3-[4-(3,4-dimethylphenyl)-4-ethyl-2,5-dioxoimidazolidin-1-yl]propanenitrile
CID 82148616
5-ethyl-5-(4-methoxy-3-methylphenyl)imidazolidine-2,4-dione
CID 71683811
2-[4-(3,4-dimethylphenyl)-4-ethyl-2,5-dioxoimidazolidin-1-yl]acetic acid
CID 75532088
3-(2-aminoethyl)-5-(3,4-dimethoxyphenyl)-5-methylimidazolidine-2,4-dione
CID 82147846
5-ethyl-3-[(5-fluoro-2-methoxyphenyl)methyl]-5-(4-fluorophenyl)imidazolidine-2,4-dione
CID 51138980
5-(4-chlorophenyl)-3-[3-(3,5-dimethylphenoxy)propyl]-5-ethylimidazolidine-2,4-dione
CID 18272138
2-[4-(4-methoxy-3-methylphenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetic acid
CID 75532099
(5R)-5-ethyl-3-[(3-fluoro-4-methoxyphenyl)methyl]-5-(4-methoxyphenyl)imidazolidine-2,4-dione
CID 7595608
5-ethyl-5-(4-fluorophenyl)-3-(2-methoxyethyl)imidazolidine-2,4-dione
CID 46647994
(5S)-3-[(2,5-dimethoxyphenyl)methyl]-5-ethyl-5-(4-fluorophenyl)imidazolidine-2,4-dione
CID 8571287
5-(2-aminoethyl)-5-(3,4-dimethylphenyl)-3-methylimidazolidine-2,4-dione
CID 82302226

Frequently Asked Questions

What is the IUPAC name of 3-(3-aminopropyl)-5-ethyl-5-(4-methoxy-3-methylphenyl)imidazolidine-2,4-dione?
The IUPAC name of 3-(3-aminopropyl)-5-ethyl-5-(4-methoxy-3-methylphenyl)imidazolidine-2,4-dione (CID 82147903) is 3-(3-aminopropyl)-5-ethyl-5-(4-methoxy-3-methylphenyl)imidazolidine-2,4-dione.
What is the SMILES notation for 3-(3-aminopropyl)-5-ethyl-5-(4-methoxy-3-methylphenyl)imidazolidine-2,4-dione?
The canonical SMILES for 3-(3-aminopropyl)-5-ethyl-5-(4-methoxy-3-methylphenyl)imidazolidine-2,4-dione is CCC1(c2ccc(OC)c(C)c2)NC(=O)N(CCCN)C1=O.
What is the InChIKey of 3-(3-aminopropyl)-5-ethyl-5-(4-methoxy-3-methylphenyl)imidazolidine-2,4-dione?
The InChIKey is YYWSPOSFWFKXGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N3O3/c1-4-16(12-6-7-13(22-3)11(2)10-12)14(20)19(9-5-8-17)15(21)18-16/h6-7,10H,4-5,8-9,17H2,1-3H3,(H,18,21).
What are the key properties of 3-(3-aminopropyl)-5-ethyl-5-(4-methoxy-3-methylphenyl)imidazolidine-2,4-dione?
3-(3-aminopropyl)-5-ethyl-5-(4-methoxy-3-methylphenyl)imidazolidine-2,4-dione has a molecular weight of 305.38 g/mol, XLogP of 1.51, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-aminopropyl)-5-ethyl-5-(4-methoxy-3-methylphenyl)imidazolidine-2,4-dione is sourced from PubChem (CID 82147903), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).