2-ethyl-4-methoxy-1-prop-1-en-2-ylbenzene;5-ethyl-5-(4-propan-2-yloxyphenyl)imidazolidine-2,4-dione

C26H34N2O4 — CID 143510343

IUPAC2-ethyl-4-methoxy-1-prop-1-en-2-ylbenzene;5-ethyl-5-(4-propan-2-yloxyphenyl)imidazolidine-2,4-dione
SMILESC=C(C)c1ccc(OC)cc1CC.CCC1(c2ccc(OC(C)C)cc2)NC(=O)NC1=O
InChIInChI=1S/C14H18N2O3.C12H16O/c1-4-14(12(17)15-13(18)16-14)10-5-7-11(8-6-10)19-9(2)3;1-5-10-8-11(13-4)6-7-12(10)9(2)3/h5-9H,4H2,1-3H3,(H2,15,16,17,18);6-8H,2,5H2,1,3-4H3
InChIKeyNKDNGTRQUJKLNZ-UHFFFAOYSA-N
MW438.57 g/mol
LogP5.21
Rot. Bonds7

About 2-ethyl-4-methoxy-1-prop-1-en-2-ylbenzene;5-ethyl-5-(4-propan-2-yloxyphenyl)imidazolidine-2,4-dione

2-ethyl-4-methoxy-1-prop-1-en-2-ylbenzene;5-ethyl-5-(4-propan-2-yloxyphenyl)imidazolidine-2,4-dione (PubChem CID 143510343) has the molecular formula C26H34N2O4 and a molecular weight of 438.57 g/mol. Its IUPAC name is 2-ethyl-4-methoxy-1-prop-1-en-2-ylbenzene;5-ethyl-5-(4-propan-2-yloxyphenyl)imidazolidine-2,4-dione.

Molecular Properties

Compound Name2-ethyl-4-methoxy-1-prop-1-en-2-ylbenzene;5-ethyl-5-(4-propan-2-yloxyphenyl)imidazolidine-2,4-dione
PubChem CID143510343
Molecular FormulaC26H34N2O4
Molecular Weight438.57 g/mol
Exact Mass438.25
IUPAC Name2-ethyl-4-methoxy-1-prop-1-en-2-ylbenzene;5-ethyl-5-(4-propan-2-yloxyphenyl)imidazolidine-2,4-dione
SMILESC=C(C)c1ccc(OC)cc1CC.CCC1(c2ccc(OC(C)C)cc2)NC(=O)NC1=O
InChIInChI=1S/C14H18N2O3.C12H16O/c1-4-14(12(17)15-13(18)16-14)10-5-7-11(8-6-10)19-9(2)3;1-5-10-8-11(13-4)6-7-12(10)9(2)3/h5-9H,4H2,1-3H3,(H2,15,16,17,18);6-8H,2,5H2,1,3-4H3
InChIKeyNKDNGTRQUJKLNZ-UHFFFAOYSA-N
XLogP5.21
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500438.57
LogP ≤ 55.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-ethyl-4-methoxy-1-prop-1-en-2-ylbenzene
CID 70232732
5-(3,4-dimethoxyphenyl)-5-ethylimidazolidine-2,4-dione
CID 71683812
N-[[(4R)-2,5-dioxo-4-(4-propan-2-yloxyphenyl)imidazolidin-4-yl]methyl]-N-[(3Z,5E)-5-methoxy-2-methylidenehepta-3,5-dienyl]formamide
CID 89190924
(5S)-5-ethyl-5-(4-methylphenyl)imidazolidine-2,4-dione
CID 7128778
1-ethyl-4-methoxy-2-prop-1-en-2-ylbenzene
CID 70233927
2-[4-ethyl-2,5-dioxo-4-(4-propan-2-yloxyphenyl)imidazolidin-1-yl]acetic acid
CID 75532094
5-ethyl-5-(4-methoxy-3-methylphenyl)imidazolidine-2,4-dione
CID 71683811
propan-2-yl 2-ethyl-4-propan-2-yloxybenzoate
CID 82552007
4-(2-ethyl-4-propan-2-yloxyphenyl)-4-oxobutanoic acid
CID 82267401
2-[[[(4R)-4-(4-hydroxyphenyl)-2,5-dioxoimidazolidin-4-yl]methylamino]methyl]-5-methoxybenzaldehyde
CID 143510183
5-(2-ethyl-4-propan-2-yloxyphenyl)-5-oxopentanoic acid
CID 82267403
5-ethyl-5-(4-methoxy-3-nitrophenyl)imidazolidine-2,4-dione
CID 82098446

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-4-methoxy-1-prop-1-en-2-ylbenzene;5-ethyl-5-(4-propan-2-yloxyphenyl)imidazolidine-2,4-dione?
The IUPAC name of 2-ethyl-4-methoxy-1-prop-1-en-2-ylbenzene;5-ethyl-5-(4-propan-2-yloxyphenyl)imidazolidine-2,4-dione (CID 143510343) is 2-ethyl-4-methoxy-1-prop-1-en-2-ylbenzene;5-ethyl-5-(4-propan-2-yloxyphenyl)imidazolidine-2,4-dione.
What is the SMILES notation for 2-ethyl-4-methoxy-1-prop-1-en-2-ylbenzene;5-ethyl-5-(4-propan-2-yloxyphenyl)imidazolidine-2,4-dione?
The canonical SMILES for 2-ethyl-4-methoxy-1-prop-1-en-2-ylbenzene;5-ethyl-5-(4-propan-2-yloxyphenyl)imidazolidine-2,4-dione is C=C(C)c1ccc(OC)cc1CC.CCC1(c2ccc(OC(C)C)cc2)NC(=O)NC1=O.
What is the InChIKey of 2-ethyl-4-methoxy-1-prop-1-en-2-ylbenzene;5-ethyl-5-(4-propan-2-yloxyphenyl)imidazolidine-2,4-dione?
The InChIKey is NKDNGTRQUJKLNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O3.C12H16O/c1-4-14(12(17)15-13(18)16-14)10-5-7-11(8-6-10)19-9(2)3;1-5-10-8-11(13-4)6-7-12(10)9(2)3/h5-9H,4H2,1-3H3,(H2,15,16,17,18);6-8H,2,5H2,1,3-4H3.
What are the key properties of 2-ethyl-4-methoxy-1-prop-1-en-2-ylbenzene;5-ethyl-5-(4-propan-2-yloxyphenyl)imidazolidine-2,4-dione?
2-ethyl-4-methoxy-1-prop-1-en-2-ylbenzene;5-ethyl-5-(4-propan-2-yloxyphenyl)imidazolidine-2,4-dione has a molecular weight of 438.57 g/mol, XLogP of 5.21, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-4-methoxy-1-prop-1-en-2-ylbenzene;5-ethyl-5-(4-propan-2-yloxyphenyl)imidazolidine-2,4-dione is sourced from PubChem (CID 143510343), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).