N-(3,5-dimethoxyphenyl)-2-(2,5-dioxo-4-phenyl-4-propylimidazolidin-1-yl)acetamide

C22H25N3O5 — CID 4653125

IUPACN-(3,5-dimethoxyphenyl)-2-(2,5-dioxo-4-phenyl-4-propylimidazolidin-1-yl)acetamide
SMILESCCCC1(c2ccccc2)NC(=O)N(CC(=O)Nc2cc(OC)cc(OC)c2)C1=O
InChIInChI=1S/C22H25N3O5/c1-4-10-22(15-8-6-5-7-9-15)20(27)25(21(28)24-22)14-19(26)23-16-11-17(29-2)13-18(12-16)30-3/h5-9,11-13H,4,10,14H2,1-3H3,(H,23,26)(H,24,28)
InChIKeyRSOGPLNLPQJFAQ-UHFFFAOYSA-N
MW411.46 g/mol
LogP2.89
Rot. Bonds8

About N-(3,5-dimethoxyphenyl)-2-(2,5-dioxo-4-phenyl-4-propylimidazolidin-1-yl)acetamide

N-(3,5-dimethoxyphenyl)-2-(2,5-dioxo-4-phenyl-4-propylimidazolidin-1-yl)acetamide (PubChem CID 4653125) has the molecular formula C22H25N3O5 and a molecular weight of 411.46 g/mol. Its IUPAC name is N-(3,5-dimethoxyphenyl)-2-(2,5-dioxo-4-phenyl-4-propylimidazolidin-1-yl)acetamide.

Molecular Properties

Compound NameN-(3,5-dimethoxyphenyl)-2-(2,5-dioxo-4-phenyl-4-propylimidazolidin-1-yl)acetamide
PubChem CID4653125
Molecular FormulaC22H25N3O5
Molecular Weight411.46 g/mol
Exact Mass411.18
IUPAC NameN-(3,5-dimethoxyphenyl)-2-(2,5-dioxo-4-phenyl-4-propylimidazolidin-1-yl)acetamide
SMILESCCCC1(c2ccccc2)NC(=O)N(CC(=O)Nc2cc(OC)cc(OC)c2)C1=O
InChIInChI=1S/C22H25N3O5/c1-4-10-22(15-8-6-5-7-9-15)20(27)25(21(28)24-22)14-19(26)23-16-11-17(29-2)13-18(12-16)30-3/h5-9,11-13H,4,10,14H2,1-3H3,(H,23,26)(H,24,28)
InChIKeyRSOGPLNLPQJFAQ-UHFFFAOYSA-N
XLogP2.89
TPSA96.97 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500411.46
LogP ≤ 52.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-(3,5-dimethoxyphenyl)-2-(2,5-dioxo-4-phenyl-4-propylimidazolidin-1-yl)acetamide?
The IUPAC name of N-(3,5-dimethoxyphenyl)-2-(2,5-dioxo-4-phenyl-4-propylimidazolidin-1-yl)acetamide (CID 4653125) is N-(3,5-dimethoxyphenyl)-2-(2,5-dioxo-4-phenyl-4-propylimidazolidin-1-yl)acetamide.
What is the SMILES notation for N-(3,5-dimethoxyphenyl)-2-(2,5-dioxo-4-phenyl-4-propylimidazolidin-1-yl)acetamide?
The canonical SMILES for N-(3,5-dimethoxyphenyl)-2-(2,5-dioxo-4-phenyl-4-propylimidazolidin-1-yl)acetamide is CCCC1(c2ccccc2)NC(=O)N(CC(=O)Nc2cc(OC)cc(OC)c2)C1=O.
What is the InChIKey of N-(3,5-dimethoxyphenyl)-2-(2,5-dioxo-4-phenyl-4-propylimidazolidin-1-yl)acetamide?
The InChIKey is RSOGPLNLPQJFAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H25N3O5/c1-4-10-22(15-8-6-5-7-9-15)20(27)25(21(28)24-22)14-19(26)23-16-11-17(29-2)13-18(12-16)30-3/h5-9,11-13H,4,10,14H2,1-3H3,(H,23,26)(H,24,28).
What are the key properties of N-(3,5-dimethoxyphenyl)-2-(2,5-dioxo-4-phenyl-4-propylimidazolidin-1-yl)acetamide?
N-(3,5-dimethoxyphenyl)-2-(2,5-dioxo-4-phenyl-4-propylimidazolidin-1-yl)acetamide has a molecular weight of 411.46 g/mol, XLogP of 2.89, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-dimethoxyphenyl)-2-(2,5-dioxo-4-phenyl-4-propylimidazolidin-1-yl)acetamide is sourced from PubChem (CID 4653125), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).