5-[(4-methoxyphenyl)methyl]-5-propylimidazolidine-2,4-dione

C14H18N2O3 — CID 54342646

IUPAC5-[(4-methoxyphenyl)methyl]-5-propylimidazolidine-2,4-dione
SMILESCCCC1(Cc2ccc(OC)cc2)NC(=O)NC1=O
InChIInChI=1S/C14H18N2O3/c1-3-8-14(12(17)15-13(18)16-14)9-10-4-6-11(19-2)7-5-10/h4-7H,3,8-9H2,1-2H3,(H2,15,16,17,18)
InChIKeyUABWVSANIMCAHJ-UHFFFAOYSA-N
MW262.31 g/mol
LogP1.62
Rot. Bonds5

About 5-[(4-methoxyphenyl)methyl]-5-propylimidazolidine-2,4-dione

5-[(4-methoxyphenyl)methyl]-5-propylimidazolidine-2,4-dione (PubChem CID 54342646) has the molecular formula C14H18N2O3 and a molecular weight of 262.31 g/mol. Its IUPAC name is 5-[(4-methoxyphenyl)methyl]-5-propylimidazolidine-2,4-dione.

Molecular Properties

Compound Name5-[(4-methoxyphenyl)methyl]-5-propylimidazolidine-2,4-dione
PubChem CID54342646
Molecular FormulaC14H18N2O3
Molecular Weight262.31 g/mol
Exact Mass262.13
IUPAC Name5-[(4-methoxyphenyl)methyl]-5-propylimidazolidine-2,4-dione
SMILESCCCC1(Cc2ccc(OC)cc2)NC(=O)NC1=O
InChIInChI=1S/C14H18N2O3/c1-3-8-14(12(17)15-13(18)16-14)9-10-4-6-11(19-2)7-5-10/h4-7H,3,8-9H2,1-2H3,(H2,15,16,17,18)
InChIKeyUABWVSANIMCAHJ-UHFFFAOYSA-N
XLogP1.62
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.31
LogP ≤ 51.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

5-[[3,5-diamino-4-(4-methoxyphenoxy)phenyl]methyl]-5-propylimidazolidine-2,4-dione
CID 54478750
5-[[4-[2-[4-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-2,5-dioxoimidazolidin-4-yl]ethynyl]phenyl]methyl]-5-pentylimidazolidine-2,4-dione
CID 91395948
ethane;1-methoxy-4-propylbenzene
CID 142085762
5-octyl-5-pentylimidazolidine-2,4-dione
CID 21324142
5-[[3,5-diiodo-4-(4-methoxyphenoxy)phenyl]methyl]-5-methylimidazolidine-2,4-dione
CID 134990734
1-methoxy-4-[(4-propylphenyl)methyl]benzene
CID 67608407
ethanamine;1-methoxy-4-propylbenzene
CID 19382800
5-ethyl-1-[2-(4-methoxyphenyl)ethyl]-5-methylimidazolidine-2,4-dione
CID 65444998
1-[2-(4-methoxyphenyl)ethyl]-3-azabicyclo[3.1.1]heptane-2,4-dione
CID 167652584
5-[(4-ethoxyphenyl)methyl]-5-(2-pyridin-4-ylethyl)-1,3-diazinane-2,4,6-trione
CID 3148850
4-imino-5-[(4-methoxyphenyl)methyl]-5-methyl-1-propylimidazolidin-2-one
CID 138389048
(4-methoxyphenyl)methyl-propylazanium
CID 7959873

Frequently Asked Questions

What is the IUPAC name of 5-[(4-methoxyphenyl)methyl]-5-propylimidazolidine-2,4-dione?
The IUPAC name of 5-[(4-methoxyphenyl)methyl]-5-propylimidazolidine-2,4-dione (CID 54342646) is 5-[(4-methoxyphenyl)methyl]-5-propylimidazolidine-2,4-dione.
What is the SMILES notation for 5-[(4-methoxyphenyl)methyl]-5-propylimidazolidine-2,4-dione?
The canonical SMILES for 5-[(4-methoxyphenyl)methyl]-5-propylimidazolidine-2,4-dione is CCCC1(Cc2ccc(OC)cc2)NC(=O)NC1=O.
What is the InChIKey of 5-[(4-methoxyphenyl)methyl]-5-propylimidazolidine-2,4-dione?
The InChIKey is UABWVSANIMCAHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O3/c1-3-8-14(12(17)15-13(18)16-14)9-10-4-6-11(19-2)7-5-10/h4-7H,3,8-9H2,1-2H3,(H2,15,16,17,18).
What are the key properties of 5-[(4-methoxyphenyl)methyl]-5-propylimidazolidine-2,4-dione?
5-[(4-methoxyphenyl)methyl]-5-propylimidazolidine-2,4-dione has a molecular weight of 262.31 g/mol, XLogP of 1.62, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(4-methoxyphenyl)methyl]-5-propylimidazolidine-2,4-dione is sourced from PubChem (CID 54342646), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).