2-[(4S)-4-(4-chlorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-methyl-N-phenylacetamide

C19H18ClN3O3 — CID 2705880

IUPAC2-[(4S)-4-(4-chlorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-methyl-N-phenylacetamide
SMILESCN(C(=O)CN1C(=O)N[C@@](C)(c2ccc(Cl)cc2)C1=O)c1ccccc1
InChIInChI=1S/C19H18ClN3O3/c1-19(13-8-10-14(20)11-9-13)17(25)23(18(26)21-19)12-16(24)22(2)15-6-4-3-5-7-15/h3-11H,12H2,1-2H3,(H,21,26)/t19-/m0/s1
InChIKeyYYQCAFIPVKFWRM-IBGZPJMESA-N
MW371.82 g/mol
LogP2.77
Rot. Bonds4

About 2-[(4S)-4-(4-chlorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-methyl-N-phenylacetamide

2-[(4S)-4-(4-chlorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-methyl-N-phenylacetamide (PubChem CID 2705880) has the molecular formula C19H18ClN3O3 and a molecular weight of 371.82 g/mol. Its IUPAC name is 2-[(4S)-4-(4-chlorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-methyl-N-phenylacetamide.

Molecular Properties

Compound Name2-[(4S)-4-(4-chlorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-methyl-N-phenylacetamide
PubChem CID2705880
Molecular FormulaC19H18ClN3O3
Molecular Weight371.82 g/mol
Exact Mass371.10
IUPAC Name2-[(4S)-4-(4-chlorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-methyl-N-phenylacetamide
SMILESCN(C(=O)CN1C(=O)N[C@@](C)(c2ccc(Cl)cc2)C1=O)c1ccccc1
InChIInChI=1S/C19H18ClN3O3/c1-19(13-8-10-14(20)11-9-13)17(25)23(18(26)21-19)12-16(24)22(2)15-6-4-3-5-7-15/h3-11H,12H2,1-2H3,(H,21,26)/t19-/m0/s1
InChIKeyYYQCAFIPVKFWRM-IBGZPJMESA-N
XLogP2.77
TPSA69.72 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.82
LogP ≤ 52.77
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 2-[(4S)-4-(4-chlorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-methyl-N-phenylacetamide?
The IUPAC name of 2-[(4S)-4-(4-chlorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-methyl-N-phenylacetamide (CID 2705880) is 2-[(4S)-4-(4-chlorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-methyl-N-phenylacetamide.
What is the SMILES notation for 2-[(4S)-4-(4-chlorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-methyl-N-phenylacetamide?
The canonical SMILES for 2-[(4S)-4-(4-chlorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-methyl-N-phenylacetamide is CN(C(=O)CN1C(=O)N[C@@](C)(c2ccc(Cl)cc2)C1=O)c1ccccc1.
What is the InChIKey of 2-[(4S)-4-(4-chlorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-methyl-N-phenylacetamide?
The InChIKey is YYQCAFIPVKFWRM-IBGZPJMESA-N. The full InChI is InChI=1S/C19H18ClN3O3/c1-19(13-8-10-14(20)11-9-13)17(25)23(18(26)21-19)12-16(24)22(2)15-6-4-3-5-7-15/h3-11H,12H2,1-2H3,(H,21,26)/t19-/m0/s1.
What are the key properties of 2-[(4S)-4-(4-chlorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-methyl-N-phenylacetamide?
2-[(4S)-4-(4-chlorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-methyl-N-phenylacetamide has a molecular weight of 371.82 g/mol, XLogP of 2.77, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4S)-4-(4-chlorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-methyl-N-phenylacetamide is sourced from PubChem (CID 2705880), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).