3-[(6-methoxynaphthalen-2-yl)methyl]-1-methyl-5-phenylimidazolidine-2,4-dione

C22H20N2O3 — CID 154863473

IUPAC3-[(6-methoxynaphthalen-2-yl)methyl]-1-methyl-5-phenylimidazolidine-2,4-dione
SMILESCOc1ccc2cc(CN3C(=O)C(c4ccccc4)N(C)C3=O)ccc2c1
InChIInChI=1S/C22H20N2O3/c1-23-20(16-6-4-3-5-7-16)21(25)24(22(23)26)14-15-8-9-18-13-19(27-2)11-10-17(18)12-15/h3-13,20H,14H2,1-2H3
InChIKeyWPFZEKFPWOARTB-UHFFFAOYSA-N
MW360.41 g/mol
LogP3.98
Rot. Bonds4

About 3-[(6-methoxynaphthalen-2-yl)methyl]-1-methyl-5-phenylimidazolidine-2,4-dione

3-[(6-methoxynaphthalen-2-yl)methyl]-1-methyl-5-phenylimidazolidine-2,4-dione (PubChem CID 154863473) has the molecular formula C22H20N2O3 and a molecular weight of 360.41 g/mol. Its IUPAC name is 3-[(6-methoxynaphthalen-2-yl)methyl]-1-methyl-5-phenylimidazolidine-2,4-dione.

Molecular Properties

Compound Name3-[(6-methoxynaphthalen-2-yl)methyl]-1-methyl-5-phenylimidazolidine-2,4-dione
PubChem CID154863473
Molecular FormulaC22H20N2O3
Molecular Weight360.41 g/mol
Exact Mass360.15
IUPAC Name3-[(6-methoxynaphthalen-2-yl)methyl]-1-methyl-5-phenylimidazolidine-2,4-dione
SMILESCOc1ccc2cc(CN3C(=O)C(c4ccccc4)N(C)C3=O)ccc2c1
InChIInChI=1S/C22H20N2O3/c1-23-20(16-6-4-3-5-7-16)21(25)24(22(23)26)14-15-8-9-18-13-19(27-2)11-10-17(18)12-15/h3-13,20H,14H2,1-2H3
InChIKeyWPFZEKFPWOARTB-UHFFFAOYSA-N
XLogP3.98
TPSA49.85 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.41
LogP ≤ 53.98
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 3-[(6-methoxynaphthalen-2-yl)methyl]-1-methyl-5-phenylimidazolidine-2,4-dione?
The IUPAC name of 3-[(6-methoxynaphthalen-2-yl)methyl]-1-methyl-5-phenylimidazolidine-2,4-dione (CID 154863473) is 3-[(6-methoxynaphthalen-2-yl)methyl]-1-methyl-5-phenylimidazolidine-2,4-dione.
What is the SMILES notation for 3-[(6-methoxynaphthalen-2-yl)methyl]-1-methyl-5-phenylimidazolidine-2,4-dione?
The canonical SMILES for 3-[(6-methoxynaphthalen-2-yl)methyl]-1-methyl-5-phenylimidazolidine-2,4-dione is COc1ccc2cc(CN3C(=O)C(c4ccccc4)N(C)C3=O)ccc2c1.
What is the InChIKey of 3-[(6-methoxynaphthalen-2-yl)methyl]-1-methyl-5-phenylimidazolidine-2,4-dione?
The InChIKey is WPFZEKFPWOARTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20N2O3/c1-23-20(16-6-4-3-5-7-16)21(25)24(22(23)26)14-15-8-9-18-13-19(27-2)11-10-17(18)12-15/h3-13,20H,14H2,1-2H3.
What are the key properties of 3-[(6-methoxynaphthalen-2-yl)methyl]-1-methyl-5-phenylimidazolidine-2,4-dione?
3-[(6-methoxynaphthalen-2-yl)methyl]-1-methyl-5-phenylimidazolidine-2,4-dione has a molecular weight of 360.41 g/mol, XLogP of 3.98, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(6-methoxynaphthalen-2-yl)methyl]-1-methyl-5-phenylimidazolidine-2,4-dione is sourced from PubChem (CID 154863473), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).