2-[4-[(4R)-4-methyl-2,5-dioxoimidazolidin-4-yl]phenoxy]-N-phenyl-N-propan-2-ylacetamide

C21H23N3O4 — CID 2385071

IUPAC2-[4-[(4R)-4-methyl-2,5-dioxoimidazolidin-4-yl]phenoxy]-N-phenyl-N-propan-2-ylacetamide
SMILESCC(C)N(C(=O)COc1ccc([C@@]2(C)NC(=O)NC2=O)cc1)c1ccccc1
InChIInChI=1S/C21H23N3O4/c1-14(2)24(16-7-5-4-6-8-16)18(25)13-28-17-11-9-15(10-12-17)21(3)19(26)22-20(27)23-21/h4-12,14H,13H2,1-3H3,(H2,22,23,26,27)/t21-/m1/s1
InChIKeyHRPYVCDEPGGMAT-OAQYLSRUSA-N
MW381.43 g/mol
LogP2.56
Rot. Bonds6

About 2-[4-[(4R)-4-methyl-2,5-dioxoimidazolidin-4-yl]phenoxy]-N-phenyl-N-propan-2-ylacetamide

2-[4-[(4R)-4-methyl-2,5-dioxoimidazolidin-4-yl]phenoxy]-N-phenyl-N-propan-2-ylacetamide (PubChem CID 2385071) has the molecular formula C21H23N3O4 and a molecular weight of 381.43 g/mol. Its IUPAC name is 2-[4-[(4R)-4-methyl-2,5-dioxoimidazolidin-4-yl]phenoxy]-N-phenyl-N-propan-2-ylacetamide.

Molecular Properties

Compound Name2-[4-[(4R)-4-methyl-2,5-dioxoimidazolidin-4-yl]phenoxy]-N-phenyl-N-propan-2-ylacetamide
PubChem CID2385071
Molecular FormulaC21H23N3O4
Molecular Weight381.43 g/mol
Exact Mass381.17
IUPAC Name2-[4-[(4R)-4-methyl-2,5-dioxoimidazolidin-4-yl]phenoxy]-N-phenyl-N-propan-2-ylacetamide
SMILESCC(C)N(C(=O)COc1ccc([C@@]2(C)NC(=O)NC2=O)cc1)c1ccccc1
InChIInChI=1S/C21H23N3O4/c1-14(2)24(16-7-5-4-6-8-16)18(25)13-28-17-11-9-15(10-12-17)21(3)19(26)22-20(27)23-21/h4-12,14H,13H2,1-3H3,(H2,22,23,26,27)/t21-/m1/s1
InChIKeyHRPYVCDEPGGMAT-OAQYLSRUSA-N
XLogP2.56
TPSA87.74 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.43
LogP ≤ 52.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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-[4-[(4R)-4-methyl-2,5-dioxoimidazolidin-4-yl]phenoxy]-N-phenyl-N-propan-2-ylacetamide?
The IUPAC name of 2-[4-[(4R)-4-methyl-2,5-dioxoimidazolidin-4-yl]phenoxy]-N-phenyl-N-propan-2-ylacetamide (CID 2385071) is 2-[4-[(4R)-4-methyl-2,5-dioxoimidazolidin-4-yl]phenoxy]-N-phenyl-N-propan-2-ylacetamide.
What is the SMILES notation for 2-[4-[(4R)-4-methyl-2,5-dioxoimidazolidin-4-yl]phenoxy]-N-phenyl-N-propan-2-ylacetamide?
The canonical SMILES for 2-[4-[(4R)-4-methyl-2,5-dioxoimidazolidin-4-yl]phenoxy]-N-phenyl-N-propan-2-ylacetamide is CC(C)N(C(=O)COc1ccc([C@@]2(C)NC(=O)NC2=O)cc1)c1ccccc1.
What is the InChIKey of 2-[4-[(4R)-4-methyl-2,5-dioxoimidazolidin-4-yl]phenoxy]-N-phenyl-N-propan-2-ylacetamide?
The InChIKey is HRPYVCDEPGGMAT-OAQYLSRUSA-N. The full InChI is InChI=1S/C21H23N3O4/c1-14(2)24(16-7-5-4-6-8-16)18(25)13-28-17-11-9-15(10-12-17)21(3)19(26)22-20(27)23-21/h4-12,14H,13H2,1-3H3,(H2,22,23,26,27)/t21-/m1/s1.
What are the key properties of 2-[4-[(4R)-4-methyl-2,5-dioxoimidazolidin-4-yl]phenoxy]-N-phenyl-N-propan-2-ylacetamide?
2-[4-[(4R)-4-methyl-2,5-dioxoimidazolidin-4-yl]phenoxy]-N-phenyl-N-propan-2-ylacetamide has a molecular weight of 381.43 g/mol, XLogP of 2.56, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[(4R)-4-methyl-2,5-dioxoimidazolidin-4-yl]phenoxy]-N-phenyl-N-propan-2-ylacetamide is sourced from PubChem (CID 2385071), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).