(5R)-1-[(4-methoxyphenyl)methyl]-5-methyl-3-naphthalen-1-ylimidazolidine-2,4-dione

C22H20N2O3 — CID 101259426

IUPAC(5R)-1-[(4-methoxyphenyl)methyl]-5-methyl-3-naphthalen-1-ylimidazolidine-2,4-dione
SMILESCOc1ccc(CN2C(=O)N(c3cccc4ccccc34)C(=O)[C@H]2C)cc1
InChIInChI=1S/C22H20N2O3/c1-15-21(25)24(20-9-5-7-17-6-3-4-8-19(17)20)22(26)23(15)14-16-10-12-18(27-2)13-11-16/h3-13,15H,14H2,1-2H3/t15-/m1/s1
InChIKeyYWNGIQVIXWMFSE-OAHLLOKOSA-N
MW360.41 g/mol
LogP4.21
Rot. Bonds4

About (5R)-1-[(4-methoxyphenyl)methyl]-5-methyl-3-naphthalen-1-ylimidazolidine-2,4-dione

(5R)-1-[(4-methoxyphenyl)methyl]-5-methyl-3-naphthalen-1-ylimidazolidine-2,4-dione (PubChem CID 101259426) has the molecular formula C22H20N2O3 and a molecular weight of 360.41 g/mol. Its IUPAC name is (5R)-1-[(4-methoxyphenyl)methyl]-5-methyl-3-naphthalen-1-ylimidazolidine-2,4-dione.

Molecular Properties

Compound Name(5R)-1-[(4-methoxyphenyl)methyl]-5-methyl-3-naphthalen-1-ylimidazolidine-2,4-dione
PubChem CID101259426
Molecular FormulaC22H20N2O3
Molecular Weight360.41 g/mol
Exact Mass360.15
IUPAC Name(5R)-1-[(4-methoxyphenyl)methyl]-5-methyl-3-naphthalen-1-ylimidazolidine-2,4-dione
SMILESCOc1ccc(CN2C(=O)N(c3cccc4ccccc34)C(=O)[C@H]2C)cc1
InChIInChI=1S/C22H20N2O3/c1-15-21(25)24(20-9-5-7-17-6-3-4-8-19(17)20)22(26)23(15)14-16-10-12-18(27-2)13-11-16/h3-13,15H,14H2,1-2H3/t15-/m1/s1
InChIKeyYWNGIQVIXWMFSE-OAHLLOKOSA-N
XLogP4.21
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 ≤ 54.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

(5R)-1-[(4-methoxyphenyl)methyl]-5-methyl-3-phenyl-2-sulfanylideneimidazolidin-4-one
CID 101259421
3-methoxy-2-[(4-methoxyphenyl)methyl]-3H-isoindol-1-one
CID 3653878
(5S)-1-benzyl-5-methyl-3-(4-methylphenyl)imidazolidine-2,4-dione
CID 156703225
(1S,2S,6R,7S)-8,9-bis(4-methoxyphenyl)-4-naphthalen-1-yl-1,7-diphenyl-4-azatricyclo[5.2.1.02,6]dec-8-ene-3,5,10-trione
CID 99724064
(5S)-1-benzyl-3-(4-hydroxyphenyl)-5-methylimidazolidine-2,4-dione
CID 156703188
1-benzyl-3,6-bis[(4-methoxyphenyl)methylsulfanyl]-4-[(3,4,5-trimethoxyphenyl)methyl]piperazine-2,5-dione
CID 101399116
(3R)-4-(4-methoxybenzoyl)-3-methyl-1-naphthalen-1-ylpiperazin-2-one
CID 93292659
(1R,4S)-1-(4-methoxybenzoyl)-2-[(4-methoxyphenyl)methyl]-4-methyl-1,4-dihydropyrazino[2,1-b]quinazoline-3,6-dione
CID 102116155
(4-methoxyphenyl) 4-naphthalen-1-yl-3,5-dioxo-2,4,8-triazatricyclo[5.2.1.02,6]decane-8-carboxylate
CID 23599362
4-[(4-methoxyphenyl)methyl]-3-methyl-1-(2-methylphenyl)piperazin-2-one
CID 24716569
(4R)-1-benzyl-3-[(4-methoxyphenyl)methyl]-4-phenyl-4H-pyrimidin-2-one
CID 134944587
3,4-dihydroxy-1-[(4-methoxyphenyl)methyl]-3H-quinoxalin-2-one
CID 70055125

Frequently Asked Questions

What is the IUPAC name of (5R)-1-[(4-methoxyphenyl)methyl]-5-methyl-3-naphthalen-1-ylimidazolidine-2,4-dione?
The IUPAC name of (5R)-1-[(4-methoxyphenyl)methyl]-5-methyl-3-naphthalen-1-ylimidazolidine-2,4-dione (CID 101259426) is (5R)-1-[(4-methoxyphenyl)methyl]-5-methyl-3-naphthalen-1-ylimidazolidine-2,4-dione.
What is the SMILES notation for (5R)-1-[(4-methoxyphenyl)methyl]-5-methyl-3-naphthalen-1-ylimidazolidine-2,4-dione?
The canonical SMILES for (5R)-1-[(4-methoxyphenyl)methyl]-5-methyl-3-naphthalen-1-ylimidazolidine-2,4-dione is COc1ccc(CN2C(=O)N(c3cccc4ccccc34)C(=O)[C@H]2C)cc1.
What is the InChIKey of (5R)-1-[(4-methoxyphenyl)methyl]-5-methyl-3-naphthalen-1-ylimidazolidine-2,4-dione?
The InChIKey is YWNGIQVIXWMFSE-OAHLLOKOSA-N. The full InChI is InChI=1S/C22H20N2O3/c1-15-21(25)24(20-9-5-7-17-6-3-4-8-19(17)20)22(26)23(15)14-16-10-12-18(27-2)13-11-16/h3-13,15H,14H2,1-2H3/t15-/m1/s1.
What are the key properties of (5R)-1-[(4-methoxyphenyl)methyl]-5-methyl-3-naphthalen-1-ylimidazolidine-2,4-dione?
(5R)-1-[(4-methoxyphenyl)methyl]-5-methyl-3-naphthalen-1-ylimidazolidine-2,4-dione has a molecular weight of 360.41 g/mol, XLogP of 4.21, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5R)-1-[(4-methoxyphenyl)methyl]-5-methyl-3-naphthalen-1-ylimidazolidine-2,4-dione is sourced from PubChem (CID 101259426), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).