2-[(4R)-2,5-dioxo-4-(4-propan-2-ylphenyl)imidazolidin-1-yl]-N-(4-ethylphenyl)acetamide

C22H25N3O3 — CID 2525762

IUPAC2-[(4R)-2,5-dioxo-4-(4-propan-2-ylphenyl)imidazolidin-1-yl]-N-(4-ethylphenyl)acetamide
SMILESCCc1ccc(NC(=O)CN2C(=O)N[C@H](c3ccc(C(C)C)cc3)C2=O)cc1
InChIInChI=1S/C22H25N3O3/c1-4-15-5-11-18(12-6-15)23-19(26)13-25-21(27)20(24-22(25)28)17-9-7-16(8-10-17)14(2)3/h5-12,14,20H,4,13H2,1-3H3,(H,23,26)(H,24,28)/t20-/m1/s1
InChIKeyDMYLJUVVUINCKS-HXUWFJFHSA-N
MW379.46 g/mol
LogP3.60
Rot. Bonds6

About 2-[(4R)-2,5-dioxo-4-(4-propan-2-ylphenyl)imidazolidin-1-yl]-N-(4-ethylphenyl)acetamide

2-[(4R)-2,5-dioxo-4-(4-propan-2-ylphenyl)imidazolidin-1-yl]-N-(4-ethylphenyl)acetamide (PubChem CID 2525762) has the molecular formula C22H25N3O3 and a molecular weight of 379.46 g/mol. Its IUPAC name is 2-[(4R)-2,5-dioxo-4-(4-propan-2-ylphenyl)imidazolidin-1-yl]-N-(4-ethylphenyl)acetamide.

Molecular Properties

Compound Name2-[(4R)-2,5-dioxo-4-(4-propan-2-ylphenyl)imidazolidin-1-yl]-N-(4-ethylphenyl)acetamide
PubChem CID2525762
Molecular FormulaC22H25N3O3
Molecular Weight379.46 g/mol
Exact Mass379.19
IUPAC Name2-[(4R)-2,5-dioxo-4-(4-propan-2-ylphenyl)imidazolidin-1-yl]-N-(4-ethylphenyl)acetamide
SMILESCCc1ccc(NC(=O)CN2C(=O)N[C@H](c3ccc(C(C)C)cc3)C2=O)cc1
InChIInChI=1S/C22H25N3O3/c1-4-15-5-11-18(12-6-15)23-19(26)13-25-21(27)20(24-22(25)28)17-9-7-16(8-10-17)14(2)3/h5-12,14,20H,4,13H2,1-3H3,(H,23,26)(H,24,28)/t20-/m1/s1
InChIKeyDMYLJUVVUINCKS-HXUWFJFHSA-N
XLogP3.60
TPSA78.51 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.46
LogP ≤ 53.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-(4-ethylphenyl)-2-[4-(2-methylpropyl)-2,5-dioxoimidazolidin-1-yl]acetamide
CID 4877686
N-(4-chlorophenyl)-2-(2,5-dioxo-4-phenylimidazolidin-1-yl)acetamide
CID 84571668
N-(4-anilinophenyl)-2-(2,5-dioxo-4-phenylimidazolidin-1-yl)acetamide
CID 84571858
2-[(4R)-2,5-dioxo-4-(2-phenylethyl)imidazolidin-1-yl]-N-(4-propan-2-ylphenyl)acetamide
CID 7916979
2-[(4R)-4-(4-methylphenyl)-2,5-dioxo-4,7-dihydro-3H-furo[3,4-d]pyrimidin-1-yl]-N-(4-propan-2-ylphenyl)acetamide
CID 99744677
2-[2,5-dioxo-4-(2-phenylethyl)imidazolidin-1-yl]-N-(4-ethylphenyl)acetamide
CID 17447614
2-(4,4-diethyl-2,5-dioxoimidazolidin-1-yl)-N-(4-propan-2-ylphenyl)acetamide
CID 2436338
1-(4-ethylphenyl)-3-(4-propan-2-ylphenyl)urea
CID 4111810
2-(2,5-dioxo-4-phenylimidazolidin-1-yl)-N-(4-nitrophenyl)acetamide
CID 84571824
2-(3-methyl-2,5-dioxoimidazolidin-1-yl)-N-(4-propan-2-ylphenyl)acetamide
CID 112779006
N-(4-propan-2-ylphenyl)-2-(2,4,5-trioxo-3-propan-2-ylimidazolidin-1-yl)acetamide
CID 7652393
N-[4-[(2R)-butan-2-yl]phenyl]-2-[(4R)-4-methyl-2,5-dioxo-4-(4-propan-2-ylphenyl)imidazolidin-1-yl]acetamide
CID 7595738

Frequently Asked Questions

What is the IUPAC name of 2-[(4R)-2,5-dioxo-4-(4-propan-2-ylphenyl)imidazolidin-1-yl]-N-(4-ethylphenyl)acetamide?
The IUPAC name of 2-[(4R)-2,5-dioxo-4-(4-propan-2-ylphenyl)imidazolidin-1-yl]-N-(4-ethylphenyl)acetamide (CID 2525762) is 2-[(4R)-2,5-dioxo-4-(4-propan-2-ylphenyl)imidazolidin-1-yl]-N-(4-ethylphenyl)acetamide.
What is the SMILES notation for 2-[(4R)-2,5-dioxo-4-(4-propan-2-ylphenyl)imidazolidin-1-yl]-N-(4-ethylphenyl)acetamide?
The canonical SMILES for 2-[(4R)-2,5-dioxo-4-(4-propan-2-ylphenyl)imidazolidin-1-yl]-N-(4-ethylphenyl)acetamide is CCc1ccc(NC(=O)CN2C(=O)N[C@H](c3ccc(C(C)C)cc3)C2=O)cc1.
What is the InChIKey of 2-[(4R)-2,5-dioxo-4-(4-propan-2-ylphenyl)imidazolidin-1-yl]-N-(4-ethylphenyl)acetamide?
The InChIKey is DMYLJUVVUINCKS-HXUWFJFHSA-N. The full InChI is InChI=1S/C22H25N3O3/c1-4-15-5-11-18(12-6-15)23-19(26)13-25-21(27)20(24-22(25)28)17-9-7-16(8-10-17)14(2)3/h5-12,14,20H,4,13H2,1-3H3,(H,23,26)(H,24,28)/t20-/m1/s1.
What are the key properties of 2-[(4R)-2,5-dioxo-4-(4-propan-2-ylphenyl)imidazolidin-1-yl]-N-(4-ethylphenyl)acetamide?
2-[(4R)-2,5-dioxo-4-(4-propan-2-ylphenyl)imidazolidin-1-yl]-N-(4-ethylphenyl)acetamide has a molecular weight of 379.46 g/mol, XLogP of 3.60, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4R)-2,5-dioxo-4-(4-propan-2-ylphenyl)imidazolidin-1-yl]-N-(4-ethylphenyl)acetamide is sourced from PubChem (CID 2525762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).