(5R)-5-(3-methoxyphenyl)-5-methyl-3-(naphthalen-1-ylmethyl)imidazolidine-2,4-dione

C22H20N2O3 — CID 40620869

IUPAC(5R)-5-(3-methoxyphenyl)-5-methyl-3-(naphthalen-1-ylmethyl)imidazolidine-2,4-dione
SMILESCOc1cccc([C@@]2(C)NC(=O)N(Cc3cccc4ccccc34)C2=O)c1
InChIInChI=1S/C22H20N2O3/c1-22(17-10-6-11-18(13-17)27-2)20(25)24(21(26)23-22)14-16-9-5-8-15-7-3-4-12-19(15)16/h3-13H,14H2,1-2H3,(H,23,26)/t22-/m1/s1
InChIKeyGTXOREPVQXSMCU-JOCHJYFZSA-N
MW360.41 g/mol
LogP3.82
Rot. Bonds4

About (5R)-5-(3-methoxyphenyl)-5-methyl-3-(naphthalen-1-ylmethyl)imidazolidine-2,4-dione

(5R)-5-(3-methoxyphenyl)-5-methyl-3-(naphthalen-1-ylmethyl)imidazolidine-2,4-dione (PubChem CID 40620869) has the molecular formula C22H20N2O3 and a molecular weight of 360.41 g/mol. Its IUPAC name is (5R)-5-(3-methoxyphenyl)-5-methyl-3-(naphthalen-1-ylmethyl)imidazolidine-2,4-dione.

Molecular Properties

Compound Name(5R)-5-(3-methoxyphenyl)-5-methyl-3-(naphthalen-1-ylmethyl)imidazolidine-2,4-dione
PubChem CID40620869
Molecular FormulaC22H20N2O3
Molecular Weight360.41 g/mol
Exact Mass360.15
IUPAC Name(5R)-5-(3-methoxyphenyl)-5-methyl-3-(naphthalen-1-ylmethyl)imidazolidine-2,4-dione
SMILESCOc1cccc([C@@]2(C)NC(=O)N(Cc3cccc4ccccc34)C2=O)c1
InChIInChI=1S/C22H20N2O3/c1-22(17-10-6-11-18(13-17)27-2)20(25)24(21(26)23-22)14-16-9-5-8-15-7-3-4-12-19(15)16/h3-13H,14H2,1-2H3,(H,23,26)/t22-/m1/s1
InChIKeyGTXOREPVQXSMCU-JOCHJYFZSA-N
XLogP3.82
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.41
LogP ≤ 53.82
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)-5-(3-methoxyphenyl)-5-methyl-3-(naphthalen-1-ylmethyl)imidazolidine-2,4-dione?
The IUPAC name of (5R)-5-(3-methoxyphenyl)-5-methyl-3-(naphthalen-1-ylmethyl)imidazolidine-2,4-dione (CID 40620869) is (5R)-5-(3-methoxyphenyl)-5-methyl-3-(naphthalen-1-ylmethyl)imidazolidine-2,4-dione.
What is the SMILES notation for (5R)-5-(3-methoxyphenyl)-5-methyl-3-(naphthalen-1-ylmethyl)imidazolidine-2,4-dione?
The canonical SMILES for (5R)-5-(3-methoxyphenyl)-5-methyl-3-(naphthalen-1-ylmethyl)imidazolidine-2,4-dione is COc1cccc([C@@]2(C)NC(=O)N(Cc3cccc4ccccc34)C2=O)c1.
What is the InChIKey of (5R)-5-(3-methoxyphenyl)-5-methyl-3-(naphthalen-1-ylmethyl)imidazolidine-2,4-dione?
The InChIKey is GTXOREPVQXSMCU-JOCHJYFZSA-N. The full InChI is InChI=1S/C22H20N2O3/c1-22(17-10-6-11-18(13-17)27-2)20(25)24(21(26)23-22)14-16-9-5-8-15-7-3-4-12-19(15)16/h3-13H,14H2,1-2H3,(H,23,26)/t22-/m1/s1.
What are the key properties of (5R)-5-(3-methoxyphenyl)-5-methyl-3-(naphthalen-1-ylmethyl)imidazolidine-2,4-dione?
(5R)-5-(3-methoxyphenyl)-5-methyl-3-(naphthalen-1-ylmethyl)imidazolidine-2,4-dione has a molecular weight of 360.41 g/mol, XLogP of 3.82, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5R)-5-(3-methoxyphenyl)-5-methyl-3-(naphthalen-1-ylmethyl)imidazolidine-2,4-dione is sourced from PubChem (CID 40620869), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).