1-(4-fluorophenyl)-5-methyl-3-[(2-propan-2-yloxyphenyl)methyl]imidazolidine-2,4-dione

C20H21FN2O3 — CID 55884085

IUPAC1-(4-fluorophenyl)-5-methyl-3-[(2-propan-2-yloxyphenyl)methyl]imidazolidine-2,4-dione
SMILESCC(C)Oc1ccccc1CN1C(=O)C(C)N(c2ccc(F)cc2)C1=O
InChIInChI=1S/C20H21FN2O3/c1-13(2)26-18-7-5-4-6-15(18)12-22-19(24)14(3)23(20(22)25)17-10-8-16(21)9-11-17/h4-11,13-14H,12H2,1-3H3
InChIKeyZAXIFVQKAQHSEU-UHFFFAOYSA-N
MW356.40 g/mol
LogP3.97
Rot. Bonds5

About 1-(4-fluorophenyl)-5-methyl-3-[(2-propan-2-yloxyphenyl)methyl]imidazolidine-2,4-dione

1-(4-fluorophenyl)-5-methyl-3-[(2-propan-2-yloxyphenyl)methyl]imidazolidine-2,4-dione (PubChem CID 55884085) has the molecular formula C20H21FN2O3 and a molecular weight of 356.40 g/mol. Its IUPAC name is 1-(4-fluorophenyl)-5-methyl-3-[(2-propan-2-yloxyphenyl)methyl]imidazolidine-2,4-dione.

Molecular Properties

Compound Name1-(4-fluorophenyl)-5-methyl-3-[(2-propan-2-yloxyphenyl)methyl]imidazolidine-2,4-dione
PubChem CID55884085
Molecular FormulaC20H21FN2O3
Molecular Weight356.40 g/mol
Exact Mass356.15
IUPAC Name1-(4-fluorophenyl)-5-methyl-3-[(2-propan-2-yloxyphenyl)methyl]imidazolidine-2,4-dione
SMILESCC(C)Oc1ccccc1CN1C(=O)C(C)N(c2ccc(F)cc2)C1=O
InChIInChI=1S/C20H21FN2O3/c1-13(2)26-18-7-5-4-6-15(18)12-22-19(24)14(3)23(20(22)25)17-10-8-16(21)9-11-17/h4-11,13-14H,12H2,1-3H3
InChIKeyZAXIFVQKAQHSEU-UHFFFAOYSA-N
XLogP3.97
TPSA49.85 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.40
LogP ≤ 53.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-(4-fluorophenyl)-5-methyl-3-[(2-propan-2-yloxyphenyl)methyl]imidazolidine-2,4-dione?
The IUPAC name of 1-(4-fluorophenyl)-5-methyl-3-[(2-propan-2-yloxyphenyl)methyl]imidazolidine-2,4-dione (CID 55884085) is 1-(4-fluorophenyl)-5-methyl-3-[(2-propan-2-yloxyphenyl)methyl]imidazolidine-2,4-dione.
What is the SMILES notation for 1-(4-fluorophenyl)-5-methyl-3-[(2-propan-2-yloxyphenyl)methyl]imidazolidine-2,4-dione?
The canonical SMILES for 1-(4-fluorophenyl)-5-methyl-3-[(2-propan-2-yloxyphenyl)methyl]imidazolidine-2,4-dione is CC(C)Oc1ccccc1CN1C(=O)C(C)N(c2ccc(F)cc2)C1=O.
What is the InChIKey of 1-(4-fluorophenyl)-5-methyl-3-[(2-propan-2-yloxyphenyl)methyl]imidazolidine-2,4-dione?
The InChIKey is ZAXIFVQKAQHSEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21FN2O3/c1-13(2)26-18-7-5-4-6-15(18)12-22-19(24)14(3)23(20(22)25)17-10-8-16(21)9-11-17/h4-11,13-14H,12H2,1-3H3.
What are the key properties of 1-(4-fluorophenyl)-5-methyl-3-[(2-propan-2-yloxyphenyl)methyl]imidazolidine-2,4-dione?
1-(4-fluorophenyl)-5-methyl-3-[(2-propan-2-yloxyphenyl)methyl]imidazolidine-2,4-dione has a molecular weight of 356.40 g/mol, XLogP of 3.97, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-fluorophenyl)-5-methyl-3-[(2-propan-2-yloxyphenyl)methyl]imidazolidine-2,4-dione is sourced from PubChem (CID 55884085), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).