5-(furan-2-yl)-5-methyl-3-[2-(4-methylphenoxy)ethyl]imidazolidine-2,4-dione

C17H18N2O4 — CID 46640128

IUPAC5-(furan-2-yl)-5-methyl-3-[2-(4-methylphenoxy)ethyl]imidazolidine-2,4-dione
SMILESCc1ccc(OCCN2C(=O)NC(C)(c3ccco3)C2=O)cc1
InChIInChI=1S/C17H18N2O4/c1-12-5-7-13(8-6-12)22-11-9-19-15(20)17(2,18-16(19)21)14-4-3-10-23-14/h3-8,10H,9,11H2,1-2H3,(H,18,21)
InChIKeyBOCOEGHZRLPZAB-UHFFFAOYSA-N
MW314.34 g/mol
LogP2.43
Rot. Bonds5

About 5-(furan-2-yl)-5-methyl-3-[2-(4-methylphenoxy)ethyl]imidazolidine-2,4-dione

5-(furan-2-yl)-5-methyl-3-[2-(4-methylphenoxy)ethyl]imidazolidine-2,4-dione (PubChem CID 46640128) has the molecular formula C17H18N2O4 and a molecular weight of 314.34 g/mol. Its IUPAC name is 5-(furan-2-yl)-5-methyl-3-[2-(4-methylphenoxy)ethyl]imidazolidine-2,4-dione.

Molecular Properties

Compound Name5-(furan-2-yl)-5-methyl-3-[2-(4-methylphenoxy)ethyl]imidazolidine-2,4-dione
PubChem CID46640128
Molecular FormulaC17H18N2O4
Molecular Weight314.34 g/mol
Exact Mass314.13
IUPAC Name5-(furan-2-yl)-5-methyl-3-[2-(4-methylphenoxy)ethyl]imidazolidine-2,4-dione
SMILESCc1ccc(OCCN2C(=O)NC(C)(c3ccco3)C2=O)cc1
InChIInChI=1S/C17H18N2O4/c1-12-5-7-13(8-6-12)22-11-9-19-15(20)17(2,18-16(19)21)14-4-3-10-23-14/h3-8,10H,9,11H2,1-2H3,(H,18,21)
InChIKeyBOCOEGHZRLPZAB-UHFFFAOYSA-N
XLogP2.43
TPSA71.78 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.34
LogP ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

3-[2-(4-chlorophenoxy)ethyl]-5-(furan-2-yl)-5-methylimidazolidine-2,4-dione
CID 51249961
(5S)-5-(furan-2-yl)-3-[2-(2-methoxyphenoxy)ethyl]-5-methylimidazolidine-2,4-dione
CID 94498941
5-(4-chlorophenyl)-5-methyl-3-[2-(4-methylphenoxy)ethyl]imidazolidine-2,4-dione
CID 4671924
(5R)-5-methyl-3-[2-(4-methylphenoxy)ethyl]-5-[4-(trifluoromethoxy)phenyl]imidazolidine-2,4-dione
CID 52517969
5,5-diethyl-3-[2-(4-methylphenoxy)ethyl]imidazolidine-2,4-dione
CID 7181009
(5R)-5-(furan-2-yl)-5-methyl-3-[2-(4-methyl-2-oxo-1,3-thiazol-3-yl)ethyl]imidazolidine-2,4-dione
CID 94139825
(5R)-3-[3-(4-methoxyphenoxy)propyl]-5-methyl-5-(4-methylphenyl)imidazolidine-2,4-dione
CID 38853269
(5R)-3-benzyl-5-(furan-2-yl)-5-methylimidazolidine-2,4-dione
CID 51462112
(5S)-5-(furan-2-yl)-3-[(2S)-2-hydroxy-3-(3-methylphenoxy)propyl]-5-methylimidazolidine-2,4-dione
CID 94180443
N-(4-ethoxyphenyl)-2-[(4S)-4-(furan-2-yl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide
CID 92785323
3-[2-(4-methylphenoxy)ethyl]-7-thia-1,3-diazaspiro[4.4]nonane-2,4-dione
CID 42979131
(5S)-3-[2-(3-bromophenoxy)ethyl]-5-methyl-5-(4-methylphenyl)imidazolidine-2,4-dione
CID 7178203

Frequently Asked Questions

What is the IUPAC name of 5-(furan-2-yl)-5-methyl-3-[2-(4-methylphenoxy)ethyl]imidazolidine-2,4-dione?
The IUPAC name of 5-(furan-2-yl)-5-methyl-3-[2-(4-methylphenoxy)ethyl]imidazolidine-2,4-dione (CID 46640128) is 5-(furan-2-yl)-5-methyl-3-[2-(4-methylphenoxy)ethyl]imidazolidine-2,4-dione.
What is the SMILES notation for 5-(furan-2-yl)-5-methyl-3-[2-(4-methylphenoxy)ethyl]imidazolidine-2,4-dione?
The canonical SMILES for 5-(furan-2-yl)-5-methyl-3-[2-(4-methylphenoxy)ethyl]imidazolidine-2,4-dione is Cc1ccc(OCCN2C(=O)NC(C)(c3ccco3)C2=O)cc1.
What is the InChIKey of 5-(furan-2-yl)-5-methyl-3-[2-(4-methylphenoxy)ethyl]imidazolidine-2,4-dione?
The InChIKey is BOCOEGHZRLPZAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2O4/c1-12-5-7-13(8-6-12)22-11-9-19-15(20)17(2,18-16(19)21)14-4-3-10-23-14/h3-8,10H,9,11H2,1-2H3,(H,18,21).
What are the key properties of 5-(furan-2-yl)-5-methyl-3-[2-(4-methylphenoxy)ethyl]imidazolidine-2,4-dione?
5-(furan-2-yl)-5-methyl-3-[2-(4-methylphenoxy)ethyl]imidazolidine-2,4-dione has a molecular weight of 314.34 g/mol, XLogP of 2.43, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(furan-2-yl)-5-methyl-3-[2-(4-methylphenoxy)ethyl]imidazolidine-2,4-dione is sourced from PubChem (CID 46640128), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).