N-ethyl-2-(3-ethyl-2,4,5-trioxoimidazolidin-1-yl)-N-[(4-phenylmethoxyphenyl)methyl]acetamide

C23H25N3O5 — CID 9341883

IUPACN-ethyl-2-(3-ethyl-2,4,5-trioxoimidazolidin-1-yl)-N-[(4-phenylmethoxyphenyl)methyl]acetamide
SMILESCCN(Cc1ccc(OCc2ccccc2)cc1)C(=O)CN1C(=O)C(=O)N(CC)C1=O
InChIInChI=1S/C23H25N3O5/c1-3-24(20(27)15-26-22(29)21(28)25(4-2)23(26)30)14-17-10-12-19(13-11-17)31-16-18-8-6-5-7-9-18/h5-13H,3-4,14-16H2,1-2H3
InChIKeyOCFUDLHAVPQJNG-UHFFFAOYSA-N
MW423.47 g/mol
LogP2.42
Rot. Bonds9

About N-ethyl-2-(3-ethyl-2,4,5-trioxoimidazolidin-1-yl)-N-[(4-phenylmethoxyphenyl)methyl]acetamide

N-ethyl-2-(3-ethyl-2,4,5-trioxoimidazolidin-1-yl)-N-[(4-phenylmethoxyphenyl)methyl]acetamide (PubChem CID 9341883) has the molecular formula C23H25N3O5 and a molecular weight of 423.47 g/mol. Its IUPAC name is N-ethyl-2-(3-ethyl-2,4,5-trioxoimidazolidin-1-yl)-N-[(4-phenylmethoxyphenyl)methyl]acetamide.

Molecular Properties

Compound NameN-ethyl-2-(3-ethyl-2,4,5-trioxoimidazolidin-1-yl)-N-[(4-phenylmethoxyphenyl)methyl]acetamide
PubChem CID9341883
Molecular FormulaC23H25N3O5
Molecular Weight423.47 g/mol
Exact Mass423.18
IUPAC NameN-ethyl-2-(3-ethyl-2,4,5-trioxoimidazolidin-1-yl)-N-[(4-phenylmethoxyphenyl)methyl]acetamide
SMILESCCN(Cc1ccc(OCc2ccccc2)cc1)C(=O)CN1C(=O)C(=O)N(CC)C1=O
InChIInChI=1S/C23H25N3O5/c1-3-24(20(27)15-26-22(29)21(28)25(4-2)23(26)30)14-17-10-12-19(13-11-17)31-16-18-8-6-5-7-9-18/h5-13H,3-4,14-16H2,1-2H3
InChIKeyOCFUDLHAVPQJNG-UHFFFAOYSA-N
XLogP2.42
TPSA87.23 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500423.47
LogP ≤ 52.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

2-(2,5-dioxo-3-phenylimidazolidin-1-yl)-N-ethyl-N-[(4-phenylmethoxyphenyl)methyl]acetamide
CID 56522106
N-benzyl-N-ethyl-2-(2,4,5-trioxo-3-propan-2-ylimidazolidin-1-yl)acetamide
CID 7652439
2-[[2-[ethyl-[(4-phenylmethoxyphenyl)methyl]amino]-2-oxoethyl]amino]-N-methylacetamide
CID 8772652
(3S)-1-[2-[ethyl-[(4-phenylmethoxyphenyl)methyl]amino]-2-oxoethyl]piperidine-3-carboxamide
CID 8545424
N-ethyl-2-[5-(4-fluorophenyl)-2-oxo-1,3,4-oxadiazol-3-yl]-N-[(4-phenylmethoxyphenyl)methyl]acetamide
CID 27040470
N-benzyl-N-ethyl-2-(4-phenylmethoxyanilino)acetamide
CID 108999046
N-(1,3-benzodioxol-5-ylmethyl)-N-ethyl-2-(3-ethyl-2,4,5-trioxoimidazolidin-1-yl)acetamide
CID 9341742
2-(3-benzyl-2,4,5-trioxoimidazolidin-1-yl)-N-ethyl-N-[(3-fluorophenyl)methyl]acetamide
CID 9072690
N,N-diethyl-4-phenylmethoxybenzamide
CID 4958372
N-ethyl-2-(3-methyl-4-oxothieno[2,3-d]pyrimidin-2-yl)sulfanyl-N-[(4-phenylmethoxyphenyl)methyl]acetamide
CID 34646455
benzyl N-benzyl-N-ethylcarbamate
CID 70968693
ethyl 1-[2-(diethylamino)-2-oxoethyl]-6-methyl-2-oxo-4-(4-phenylmethoxyphenyl)-3,4-dihydropyridine-5-carboxylate
CID 42761464

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-(3-ethyl-2,4,5-trioxoimidazolidin-1-yl)-N-[(4-phenylmethoxyphenyl)methyl]acetamide?
The IUPAC name of N-ethyl-2-(3-ethyl-2,4,5-trioxoimidazolidin-1-yl)-N-[(4-phenylmethoxyphenyl)methyl]acetamide (CID 9341883) is N-ethyl-2-(3-ethyl-2,4,5-trioxoimidazolidin-1-yl)-N-[(4-phenylmethoxyphenyl)methyl]acetamide.
What is the SMILES notation for N-ethyl-2-(3-ethyl-2,4,5-trioxoimidazolidin-1-yl)-N-[(4-phenylmethoxyphenyl)methyl]acetamide?
The canonical SMILES for N-ethyl-2-(3-ethyl-2,4,5-trioxoimidazolidin-1-yl)-N-[(4-phenylmethoxyphenyl)methyl]acetamide is CCN(Cc1ccc(OCc2ccccc2)cc1)C(=O)CN1C(=O)C(=O)N(CC)C1=O.
What is the InChIKey of N-ethyl-2-(3-ethyl-2,4,5-trioxoimidazolidin-1-yl)-N-[(4-phenylmethoxyphenyl)methyl]acetamide?
The InChIKey is OCFUDLHAVPQJNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25N3O5/c1-3-24(20(27)15-26-22(29)21(28)25(4-2)23(26)30)14-17-10-12-19(13-11-17)31-16-18-8-6-5-7-9-18/h5-13H,3-4,14-16H2,1-2H3.
What are the key properties of N-ethyl-2-(3-ethyl-2,4,5-trioxoimidazolidin-1-yl)-N-[(4-phenylmethoxyphenyl)methyl]acetamide?
N-ethyl-2-(3-ethyl-2,4,5-trioxoimidazolidin-1-yl)-N-[(4-phenylmethoxyphenyl)methyl]acetamide has a molecular weight of 423.47 g/mol, XLogP of 2.42, 9 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-(3-ethyl-2,4,5-trioxoimidazolidin-1-yl)-N-[(4-phenylmethoxyphenyl)methyl]acetamide is sourced from PubChem (CID 9341883), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).