4-(2-ethoxyphenoxy)-N-[(4R)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]butanamide

C22H25N3O5 — CID 8879377

IUPAC4-(2-ethoxyphenoxy)-N-[(4R)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]butanamide
SMILESCCOc1ccccc1OCCCC(=O)NN1C(=O)N[C@](C)(c2ccccc2)C1=O
InChIInChI=1S/C22H25N3O5/c1-3-29-17-12-7-8-13-18(17)30-15-9-14-19(26)24-25-20(27)22(2,23-21(25)28)16-10-5-4-6-11-16/h4-8,10-13H,3,9,14-15H2,1-2H3,(H,23,28)(H,24,26)/t22-/m1/s1
InChIKeyGHBXRSJHIZLPHV-JOCHJYFZSA-N
MW411.46 g/mol
LogP2.74
Rot. Bonds9

About 4-(2-ethoxyphenoxy)-N-[(4R)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]butanamide

4-(2-ethoxyphenoxy)-N-[(4R)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]butanamide (PubChem CID 8879377) has the molecular formula C22H25N3O5 and a molecular weight of 411.46 g/mol. Its IUPAC name is 4-(2-ethoxyphenoxy)-N-[(4R)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]butanamide.

Molecular Properties

Compound Name4-(2-ethoxyphenoxy)-N-[(4R)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]butanamide
PubChem CID8879377
Molecular FormulaC22H25N3O5
Molecular Weight411.46 g/mol
Exact Mass411.18
IUPAC Name4-(2-ethoxyphenoxy)-N-[(4R)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]butanamide
SMILESCCOc1ccccc1OCCCC(=O)NN1C(=O)N[C@](C)(c2ccccc2)C1=O
InChIInChI=1S/C22H25N3O5/c1-3-29-17-12-7-8-13-18(17)30-15-9-14-19(26)24-25-20(27)22(2,23-21(25)28)16-10-5-4-6-11-16/h4-8,10-13H,3,9,14-15H2,1-2H3,(H,23,28)(H,24,26)/t22-/m1/s1
InChIKeyGHBXRSJHIZLPHV-JOCHJYFZSA-N
XLogP2.74
TPSA96.97 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500411.46
LogP ≤ 52.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze 4-(2-ethoxyphenoxy)-N-[(4R)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]butanamide with MolForge

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Related Compounds

6-[(4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl)amino]-6-oxohexanoic acid
CID 167859701
N-(4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl)propanamide
CID 47099545
N-(4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl)-N',N'-dipropylpentanediamide
CID 56546213
2-(2-chlorophenoxy)-N-(4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl)acetamide
CID 55342591
N-(4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl)-4-oxo-4-(4-propoxyphenyl)butanamide
CID 55343004
N-(4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl)-3,3-diphenylpropanamide
CID 84861647
2-[[2-(dimethylamino)-2-oxoethyl]-methylamino]-N-[(4S)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]acetamide
CID 8694880
2-(4-benzoylphenoxy)-N-(4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl)acetamide
CID 17464109
N-[(4R)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]-2-(3,4,5-trimethoxyphenyl)acetamide
CID 8879472
N-(4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl)-3-(2-oxo-3-propylbenzimidazol-1-yl)propanamide
CID 55450886
6-[[4-(3-methoxyphenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]amino]-6-oxohexanoic acid
CID 167773553
N-benzyl-4-(2-ethoxyphenoxy)butanamide
CID 78774394

Frequently Asked Questions

What is the IUPAC name of 4-(2-ethoxyphenoxy)-N-[(4R)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]butanamide?
The IUPAC name of 4-(2-ethoxyphenoxy)-N-[(4R)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]butanamide (CID 8879377) is 4-(2-ethoxyphenoxy)-N-[(4R)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]butanamide.
What is the SMILES notation for 4-(2-ethoxyphenoxy)-N-[(4R)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]butanamide?
The canonical SMILES for 4-(2-ethoxyphenoxy)-N-[(4R)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]butanamide is CCOc1ccccc1OCCCC(=O)NN1C(=O)N[C@](C)(c2ccccc2)C1=O.
What is the InChIKey of 4-(2-ethoxyphenoxy)-N-[(4R)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]butanamide?
The InChIKey is GHBXRSJHIZLPHV-JOCHJYFZSA-N. The full InChI is InChI=1S/C22H25N3O5/c1-3-29-17-12-7-8-13-18(17)30-15-9-14-19(26)24-25-20(27)22(2,23-21(25)28)16-10-5-4-6-11-16/h4-8,10-13H,3,9,14-15H2,1-2H3,(H,23,28)(H,24,26)/t22-/m1/s1.
What are the key properties of 4-(2-ethoxyphenoxy)-N-[(4R)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]butanamide?
4-(2-ethoxyphenoxy)-N-[(4R)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]butanamide has a molecular weight of 411.46 g/mol, XLogP of 2.74, 9 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-ethoxyphenoxy)-N-[(4R)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]butanamide is sourced from PubChem (CID 8879377), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).