1-benzyl-3-(4-methoxyphenyl)-4-(4-methylphenyl)-5-phenylimidazolidin-2-one

C30H28N2O2 — CID 3843715

IUPAC1-benzyl-3-(4-methoxyphenyl)-4-(4-methylphenyl)-5-phenylimidazolidin-2-one
SMILESCOc1ccc(N2C(=O)N(Cc3ccccc3)C(c3ccccc3)C2c2ccc(C)cc2)cc1
InChIInChI=1S/C30H28N2O2/c1-22-13-15-25(16-14-22)29-28(24-11-7-4-8-12-24)31(21-23-9-5-3-6-10-23)30(33)32(29)26-17-19-27(34-2)20-18-26/h3-20,28-29H,21H2,1-2H3
InChIKeyVXJHXAXTXFWYGL-UHFFFAOYSA-N
MW448.57 g/mol
LogP6.93
Rot. Bonds6

About 1-benzyl-3-(4-methoxyphenyl)-4-(4-methylphenyl)-5-phenylimidazolidin-2-one

1-benzyl-3-(4-methoxyphenyl)-4-(4-methylphenyl)-5-phenylimidazolidin-2-one (PubChem CID 3843715) has the molecular formula C30H28N2O2 and a molecular weight of 448.57 g/mol. Its IUPAC name is 1-benzyl-3-(4-methoxyphenyl)-4-(4-methylphenyl)-5-phenylimidazolidin-2-one.

Molecular Properties

Compound Name1-benzyl-3-(4-methoxyphenyl)-4-(4-methylphenyl)-5-phenylimidazolidin-2-one
PubChem CID3843715
Molecular FormulaC30H28N2O2
Molecular Weight448.57 g/mol
Exact Mass448.22
IUPAC Name1-benzyl-3-(4-methoxyphenyl)-4-(4-methylphenyl)-5-phenylimidazolidin-2-one
SMILESCOc1ccc(N2C(=O)N(Cc3ccccc3)C(c3ccccc3)C2c2ccc(C)cc2)cc1
InChIInChI=1S/C30H28N2O2/c1-22-13-15-25(16-14-22)29-28(24-11-7-4-8-12-24)31(21-23-9-5-3-6-10-23)30(33)32(29)26-17-19-27(34-2)20-18-26/h3-20,28-29H,21H2,1-2H3
InChIKeyVXJHXAXTXFWYGL-UHFFFAOYSA-N
XLogP6.93
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms34
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500448.57
LogP ≤ 56.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(4R,5R)-1-benzyl-5-butoxy-3-(4-methoxyphenyl)-4-phenylimidazolidin-2-one
CID 101122993
(4R,5R)-1,3,4,5-tetrakis(4-methoxyphenyl)imidazolidin-2-one
CID 11124062
(5R,6S)-1,3,5-tribenzyl-6-(4-methoxyphenyl)-1,3-diazinane-2,4-dione
CID 166443703
(3R,4S)-3-benzyl-1,4-bis(4-methoxyphenyl)azetidin-2-one
CID 54114179
1-benzyl-4-[hydroxy-(4-methylphenyl)methylidene]-5-(4-methoxyphenyl)pyrrolidine-2,3-dione
CID 2891265
(2R)-1-benzyl-2-(3-methoxyphenyl)-3-(4-methylphenyl)-2H-quinazolin-4-one
CID 126183550
1-benzyl-3-hydroxy-4-(4-methylphenyl)azetidin-2-one
CID 91824522
(3R,4S)-1,4-bis(4-methoxyphenyl)-3-phenylazetidin-2-one
CID 101388237
1-(4-methoxyphenyl)-3-methyl-4-(4-methylphenyl)azetidin-2-one
CID 75219177
(4S,5S)-4-tert-butyl-1,3-bis(4-methoxyphenyl)-5-phenylimidazolidin-2-one
CID 10574666
(3S,4R)-3-methoxy-1-(4-methoxyphenyl)-4-(4-methylphenyl)azetidin-2-one
CID 102052302
(3S,4S)-1,4-bis(4-methoxyphenyl)-3-(4-methylphenyl)sulfanylazetidin-2-one
CID 154585966

Frequently Asked Questions

What is the IUPAC name of 1-benzyl-3-(4-methoxyphenyl)-4-(4-methylphenyl)-5-phenylimidazolidin-2-one?
The IUPAC name of 1-benzyl-3-(4-methoxyphenyl)-4-(4-methylphenyl)-5-phenylimidazolidin-2-one (CID 3843715) is 1-benzyl-3-(4-methoxyphenyl)-4-(4-methylphenyl)-5-phenylimidazolidin-2-one.
What is the SMILES notation for 1-benzyl-3-(4-methoxyphenyl)-4-(4-methylphenyl)-5-phenylimidazolidin-2-one?
The canonical SMILES for 1-benzyl-3-(4-methoxyphenyl)-4-(4-methylphenyl)-5-phenylimidazolidin-2-one is COc1ccc(N2C(=O)N(Cc3ccccc3)C(c3ccccc3)C2c2ccc(C)cc2)cc1.
What is the InChIKey of 1-benzyl-3-(4-methoxyphenyl)-4-(4-methylphenyl)-5-phenylimidazolidin-2-one?
The InChIKey is VXJHXAXTXFWYGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H28N2O2/c1-22-13-15-25(16-14-22)29-28(24-11-7-4-8-12-24)31(21-23-9-5-3-6-10-23)30(33)32(29)26-17-19-27(34-2)20-18-26/h3-20,28-29H,21H2,1-2H3.
What are the key properties of 1-benzyl-3-(4-methoxyphenyl)-4-(4-methylphenyl)-5-phenylimidazolidin-2-one?
1-benzyl-3-(4-methoxyphenyl)-4-(4-methylphenyl)-5-phenylimidazolidin-2-one has a molecular weight of 448.57 g/mol, XLogP of 6.93, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzyl-3-(4-methoxyphenyl)-4-(4-methylphenyl)-5-phenylimidazolidin-2-one is sourced from PubChem (CID 3843715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).