3-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-5-[(2-methoxyphenyl)methyl]-5-methylimidazolidine-2,4-dione

C18H21N3O4 — CID 17391164

IUPAC3-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-5-[(2-methoxyphenyl)methyl]-5-methylimidazolidine-2,4-dione
SMILESCOc1ccccc1CC1(C)NC(=O)N(Cc2c(C)noc2C)C1=O
InChIInChI=1S/C18H21N3O4/c1-11-14(12(2)25-20-11)10-21-16(22)18(3,19-17(21)23)9-13-7-5-6-8-15(13)24-4/h5-8H,9-10H2,1-4H3,(H,19,23)
InChIKeyDBPKSQMPWGRWPW-UHFFFAOYSA-N
MW343.38 g/mol
LogP2.35
Rot. Bonds5

About 3-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-5-[(2-methoxyphenyl)methyl]-5-methylimidazolidine-2,4-dione

3-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-5-[(2-methoxyphenyl)methyl]-5-methylimidazolidine-2,4-dione (PubChem CID 17391164) has the molecular formula C18H21N3O4 and a molecular weight of 343.38 g/mol. Its IUPAC name is 3-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-5-[(2-methoxyphenyl)methyl]-5-methylimidazolidine-2,4-dione.

Molecular Properties

Compound Name3-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-5-[(2-methoxyphenyl)methyl]-5-methylimidazolidine-2,4-dione
PubChem CID17391164
Molecular FormulaC18H21N3O4
Molecular Weight343.38 g/mol
Exact Mass343.15
IUPAC Name3-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-5-[(2-methoxyphenyl)methyl]-5-methylimidazolidine-2,4-dione
SMILESCOc1ccccc1CC1(C)NC(=O)N(Cc2c(C)noc2C)C1=O
InChIInChI=1S/C18H21N3O4/c1-11-14(12(2)25-20-11)10-21-16(22)18(3,19-17(21)23)9-13-7-5-6-8-15(13)24-4/h5-8H,9-10H2,1-4H3,(H,19,23)
InChIKeyDBPKSQMPWGRWPW-UHFFFAOYSA-N
XLogP2.35
TPSA84.67 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.38
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze 3-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-5-[(2-methoxyphenyl)methyl]-5-methylimidazolidine-2,4-dione with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(5R)-3-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-5-methyl-5-(2-phenylethyl)imidazolidine-2,4-dione
CID 7170829
(5S)-5-[(2-methoxyphenyl)methyl]-5-methyl-3-[(4-nitrophenyl)methyl]imidazolidine-2,4-dione
CID 7566120
methyl 4-[[(4R)-4-[(2-methoxyphenyl)methyl]-4-methyl-2,5-dioxoimidazolidin-1-yl]methyl]benzoate
CID 7566179
methyl 4-[[(4S)-4-[(2-methoxyphenyl)methyl]-4-methyl-2,5-dioxoimidazolidin-1-yl]methyl]benzoate
CID 7566172
(5S)-3-[2-(4-fluorophenoxy)ethyl]-5-[(2-methoxyphenyl)methyl]-5-methylimidazolidine-2,4-dione
CID 7565514
(5S)-5-[(2-methoxyphenyl)methyl]-5-methyl-3-phenacylimidazolidine-2,4-dione
CID 7566809
(5R)-3-[2-(4-fluorophenyl)-2-oxoethyl]-5-[(2-methoxyphenyl)methyl]-5-methylimidazolidine-2,4-dione
CID 7566272
(5S)-5-[(2-methoxyphenyl)methyl]-3-[2-(4-methoxyphenyl)-2-oxoethyl]-5-methylimidazolidine-2,4-dione
CID 7566086
N-tert-butyl-2-[(4R)-4-[(2-methoxyphenyl)methyl]-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide
CID 7565842
2-[(4S)-4-[(2-methoxyphenyl)methyl]-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-propylacetamide
CID 7565917
(5S)-3-[2-(1-adamantyl)-2-oxoethyl]-5-[(2-methoxyphenyl)methyl]-5-methylimidazolidine-2,4-dione
CID 7565321
N-(2-ethyl-6-methylphenyl)-2-[(4S)-4-[(2-methoxyphenyl)methyl]-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide
CID 7565952

Frequently Asked Questions

What is the IUPAC name of 3-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-5-[(2-methoxyphenyl)methyl]-5-methylimidazolidine-2,4-dione?
The IUPAC name of 3-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-5-[(2-methoxyphenyl)methyl]-5-methylimidazolidine-2,4-dione (CID 17391164) is 3-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-5-[(2-methoxyphenyl)methyl]-5-methylimidazolidine-2,4-dione.
What is the SMILES notation for 3-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-5-[(2-methoxyphenyl)methyl]-5-methylimidazolidine-2,4-dione?
The canonical SMILES for 3-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-5-[(2-methoxyphenyl)methyl]-5-methylimidazolidine-2,4-dione is COc1ccccc1CC1(C)NC(=O)N(Cc2c(C)noc2C)C1=O.
What is the InChIKey of 3-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-5-[(2-methoxyphenyl)methyl]-5-methylimidazolidine-2,4-dione?
The InChIKey is DBPKSQMPWGRWPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N3O4/c1-11-14(12(2)25-20-11)10-21-16(22)18(3,19-17(21)23)9-13-7-5-6-8-15(13)24-4/h5-8H,9-10H2,1-4H3,(H,19,23).
What are the key properties of 3-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-5-[(2-methoxyphenyl)methyl]-5-methylimidazolidine-2,4-dione?
3-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-5-[(2-methoxyphenyl)methyl]-5-methylimidazolidine-2,4-dione has a molecular weight of 343.38 g/mol, XLogP of 2.35, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-5-[(2-methoxyphenyl)methyl]-5-methylimidazolidine-2,4-dione is sourced from PubChem (CID 17391164), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).