(5R)-5-(2,4-dichlorophenyl)-5-methyl-3-[2-(2-methylphenoxy)ethyl]imidazolidine-2,4-dione

C19H18Cl2N2O3 — CID 2117014

IUPAC(5R)-5-(2,4-dichlorophenyl)-5-methyl-3-[2-(2-methylphenoxy)ethyl]imidazolidine-2,4-dione
SMILESCc1ccccc1OCCN1C(=O)N[C@](C)(c2ccc(Cl)cc2Cl)C1=O
InChIInChI=1S/C19H18Cl2N2O3/c1-12-5-3-4-6-16(12)26-10-9-23-17(24)19(2,22-18(23)25)14-8-7-13(20)11-15(14)21/h3-8,11H,9-10H2,1-2H3,(H,22,25)/t19-/m1/s1
InChIKeyPZWRVMBPBVLQCM-LJQANCHMSA-N
MW393.27 g/mol
LogP4.15
Rot. Bonds5

About (5R)-5-(2,4-dichlorophenyl)-5-methyl-3-[2-(2-methylphenoxy)ethyl]imidazolidine-2,4-dione

(5R)-5-(2,4-dichlorophenyl)-5-methyl-3-[2-(2-methylphenoxy)ethyl]imidazolidine-2,4-dione (PubChem CID 2117014) has the molecular formula C19H18Cl2N2O3 and a molecular weight of 393.27 g/mol. Its IUPAC name is (5R)-5-(2,4-dichlorophenyl)-5-methyl-3-[2-(2-methylphenoxy)ethyl]imidazolidine-2,4-dione.

Molecular Properties

Compound Name(5R)-5-(2,4-dichlorophenyl)-5-methyl-3-[2-(2-methylphenoxy)ethyl]imidazolidine-2,4-dione
PubChem CID2117014
Molecular FormulaC19H18Cl2N2O3
Molecular Weight393.27 g/mol
Exact Mass392.07
IUPAC Name(5R)-5-(2,4-dichlorophenyl)-5-methyl-3-[2-(2-methylphenoxy)ethyl]imidazolidine-2,4-dione
SMILESCc1ccccc1OCCN1C(=O)N[C@](C)(c2ccc(Cl)cc2Cl)C1=O
InChIInChI=1S/C19H18Cl2N2O3/c1-12-5-3-4-6-16(12)26-10-9-23-17(24)19(2,22-18(23)25)14-8-7-13(20)11-15(14)21/h3-8,11H,9-10H2,1-2H3,(H,22,25)/t19-/m1/s1
InChIKeyPZWRVMBPBVLQCM-LJQANCHMSA-N
XLogP4.15
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500393.27
LogP ≤ 54.15
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-(2,4-dichlorophenyl)-5-methyl-3-[2-(2-methylphenoxy)ethyl]imidazolidine-2,4-dione?
The IUPAC name of (5R)-5-(2,4-dichlorophenyl)-5-methyl-3-[2-(2-methylphenoxy)ethyl]imidazolidine-2,4-dione (CID 2117014) is (5R)-5-(2,4-dichlorophenyl)-5-methyl-3-[2-(2-methylphenoxy)ethyl]imidazolidine-2,4-dione.
What is the SMILES notation for (5R)-5-(2,4-dichlorophenyl)-5-methyl-3-[2-(2-methylphenoxy)ethyl]imidazolidine-2,4-dione?
The canonical SMILES for (5R)-5-(2,4-dichlorophenyl)-5-methyl-3-[2-(2-methylphenoxy)ethyl]imidazolidine-2,4-dione is Cc1ccccc1OCCN1C(=O)N[C@](C)(c2ccc(Cl)cc2Cl)C1=O.
What is the InChIKey of (5R)-5-(2,4-dichlorophenyl)-5-methyl-3-[2-(2-methylphenoxy)ethyl]imidazolidine-2,4-dione?
The InChIKey is PZWRVMBPBVLQCM-LJQANCHMSA-N. The full InChI is InChI=1S/C19H18Cl2N2O3/c1-12-5-3-4-6-16(12)26-10-9-23-17(24)19(2,22-18(23)25)14-8-7-13(20)11-15(14)21/h3-8,11H,9-10H2,1-2H3,(H,22,25)/t19-/m1/s1.
What are the key properties of (5R)-5-(2,4-dichlorophenyl)-5-methyl-3-[2-(2-methylphenoxy)ethyl]imidazolidine-2,4-dione?
(5R)-5-(2,4-dichlorophenyl)-5-methyl-3-[2-(2-methylphenoxy)ethyl]imidazolidine-2,4-dione has a molecular weight of 393.27 g/mol, XLogP of 4.15, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5R)-5-(2,4-dichlorophenyl)-5-methyl-3-[2-(2-methylphenoxy)ethyl]imidazolidine-2,4-dione is sourced from PubChem (CID 2117014), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).