(5R)-3-[(2-fluorophenyl)methyl]-5-(3-methoxyphenyl)-5-methylimidazolidine-2,4-dione

C18H17FN2O3 — CID 41096881

IUPAC(5R)-3-[(2-fluorophenyl)methyl]-5-(3-methoxyphenyl)-5-methylimidazolidine-2,4-dione
SMILESCOc1cccc([C@@]2(C)NC(=O)N(Cc3ccccc3F)C2=O)c1
InChIInChI=1S/C18H17FN2O3/c1-18(13-7-5-8-14(10-13)24-2)16(22)21(17(23)20-18)11-12-6-3-4-9-15(12)19/h3-10H,11H2,1-2H3,(H,20,23)/t18-/m1/s1
InChIKeyKJGOHGGSSGGCTA-GOSISDBHSA-N
MW328.34 g/mol
LogP2.80
Rot. Bonds4

About (5R)-3-[(2-fluorophenyl)methyl]-5-(3-methoxyphenyl)-5-methylimidazolidine-2,4-dione

(5R)-3-[(2-fluorophenyl)methyl]-5-(3-methoxyphenyl)-5-methylimidazolidine-2,4-dione (PubChem CID 41096881) has the molecular formula C18H17FN2O3 and a molecular weight of 328.34 g/mol. Its IUPAC name is (5R)-3-[(2-fluorophenyl)methyl]-5-(3-methoxyphenyl)-5-methylimidazolidine-2,4-dione.

Molecular Properties

Compound Name(5R)-3-[(2-fluorophenyl)methyl]-5-(3-methoxyphenyl)-5-methylimidazolidine-2,4-dione
PubChem CID41096881
Molecular FormulaC18H17FN2O3
Molecular Weight328.34 g/mol
Exact Mass328.12
IUPAC Name(5R)-3-[(2-fluorophenyl)methyl]-5-(3-methoxyphenyl)-5-methylimidazolidine-2,4-dione
SMILESCOc1cccc([C@@]2(C)NC(=O)N(Cc3ccccc3F)C2=O)c1
InChIInChI=1S/C18H17FN2O3/c1-18(13-7-5-8-14(10-13)24-2)16(22)21(17(23)20-18)11-12-6-3-4-9-15(12)19/h3-10H,11H2,1-2H3,(H,20,23)/t18-/m1/s1
InChIKeyKJGOHGGSSGGCTA-GOSISDBHSA-N
XLogP2.80
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.34
LogP ≤ 52.80
H-Bond Donors ≤ 51
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 (5R)-3-[(2-fluorophenyl)methyl]-5-(3-methoxyphenyl)-5-methylimidazolidine-2,4-dione?
The IUPAC name of (5R)-3-[(2-fluorophenyl)methyl]-5-(3-methoxyphenyl)-5-methylimidazolidine-2,4-dione (CID 41096881) is (5R)-3-[(2-fluorophenyl)methyl]-5-(3-methoxyphenyl)-5-methylimidazolidine-2,4-dione.
What is the SMILES notation for (5R)-3-[(2-fluorophenyl)methyl]-5-(3-methoxyphenyl)-5-methylimidazolidine-2,4-dione?
The canonical SMILES for (5R)-3-[(2-fluorophenyl)methyl]-5-(3-methoxyphenyl)-5-methylimidazolidine-2,4-dione is COc1cccc([C@@]2(C)NC(=O)N(Cc3ccccc3F)C2=O)c1.
What is the InChIKey of (5R)-3-[(2-fluorophenyl)methyl]-5-(3-methoxyphenyl)-5-methylimidazolidine-2,4-dione?
The InChIKey is KJGOHGGSSGGCTA-GOSISDBHSA-N. The full InChI is InChI=1S/C18H17FN2O3/c1-18(13-7-5-8-14(10-13)24-2)16(22)21(17(23)20-18)11-12-6-3-4-9-15(12)19/h3-10H,11H2,1-2H3,(H,20,23)/t18-/m1/s1.
What are the key properties of (5R)-3-[(2-fluorophenyl)methyl]-5-(3-methoxyphenyl)-5-methylimidazolidine-2,4-dione?
(5R)-3-[(2-fluorophenyl)methyl]-5-(3-methoxyphenyl)-5-methylimidazolidine-2,4-dione has a molecular weight of 328.34 g/mol, XLogP of 2.80, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5R)-3-[(2-fluorophenyl)methyl]-5-(3-methoxyphenyl)-5-methylimidazolidine-2,4-dione is sourced from PubChem (CID 41096881), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).