N-[4-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)butyl]-2-pyridin-4-ylacetamide

C26H26N4O3 — CID 70826266

IUPACN-[4-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)butyl]-2-pyridin-4-ylacetamide
SMILESO=C(Cc1ccncc1)NCCCCN1C(=O)NC(c2ccccc2)(c2ccccc2)C1=O
InChIInChI=1S/C26H26N4O3/c31-23(19-20-13-16-27-17-14-20)28-15-7-8-18-30-24(32)26(29-25(30)33,21-9-3-1-4-10-21)22-11-5-2-6-12-22/h1-6,9-14,16-17H,7-8,15,18-19H2,(H,28,31)(H,29,33)
InChIKeyUZGWSNZVDWYTCD-UHFFFAOYSA-N
MW442.52 g/mol
LogP3.02
Rot. Bonds9

About N-[4-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)butyl]-2-pyridin-4-ylacetamide

N-[4-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)butyl]-2-pyridin-4-ylacetamide (PubChem CID 70826266) has the molecular formula C26H26N4O3 and a molecular weight of 442.52 g/mol. Its IUPAC name is N-[4-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)butyl]-2-pyridin-4-ylacetamide.

Molecular Properties

Compound NameN-[4-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)butyl]-2-pyridin-4-ylacetamide
PubChem CID70826266
Molecular FormulaC26H26N4O3
Molecular Weight442.52 g/mol
Exact Mass442.20
IUPAC NameN-[4-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)butyl]-2-pyridin-4-ylacetamide
SMILESO=C(Cc1ccncc1)NCCCCN1C(=O)NC(c2ccccc2)(c2ccccc2)C1=O
InChIInChI=1S/C26H26N4O3/c31-23(19-20-13-16-27-17-14-20)28-15-7-8-18-30-24(32)26(29-25(30)33,21-9-3-1-4-10-21)22-11-5-2-6-12-22/h1-6,9-14,16-17H,7-8,15,18-19H2,(H,28,31)(H,29,33)
InChIKeyUZGWSNZVDWYTCD-UHFFFAOYSA-N
XLogP3.02
TPSA91.40 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500442.52
LogP ≤ 53.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

3-decyl-5,5-diphenylimidazolidine-2,4-dione
CID 11696827
3-hexyl-5,5-diphenylimidazolidine-2,4-dione
CID 24860362
5,5-diphenyl-3-(3-sulfanylpropyl)imidazolidine-2,4-dione
CID 102066490
5-phenyl-3-[3-(4-phenylpiperidin-1-yl)propyl]-5-pyridin-4-ylimidazolidine-2,4-dione
CID 21395250
2-amino-5-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)pentanoic acid
CID 3084726
5,5-diphenyl-3-(4-phenylsulfanylbutyl)imidazolidine-2,4-dione
CID 2221675
6-[(2-pyridin-4-ylacetyl)amino]hexanoic acid
CID 16789577
7-[(2-pyridin-4-ylacetyl)amino]heptanoic acid
CID 24700548
2-[(4S)-4-(3,4-dimethylphenyl)-2,5-dioxo-4-phenylimidazolidin-1-yl]-N-(3-methoxypropyl)acetamide
CID 8673028
S-[(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)methyl] 2-aminoethanethioate
CID 54266354
2-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)-N-(2-morpholin-4-ylethyl)acetamide;hydrochloride
CID 138397580
3-[2-(2-methylimidazol-1-yl)ethyl]-5,5-diphenylimidazolidine-2,4-dione
CID 75399916

Frequently Asked Questions

What is the IUPAC name of N-[4-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)butyl]-2-pyridin-4-ylacetamide?
The IUPAC name of N-[4-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)butyl]-2-pyridin-4-ylacetamide (CID 70826266) is N-[4-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)butyl]-2-pyridin-4-ylacetamide.
What is the SMILES notation for N-[4-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)butyl]-2-pyridin-4-ylacetamide?
The canonical SMILES for N-[4-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)butyl]-2-pyridin-4-ylacetamide is O=C(Cc1ccncc1)NCCCCN1C(=O)NC(c2ccccc2)(c2ccccc2)C1=O.
What is the InChIKey of N-[4-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)butyl]-2-pyridin-4-ylacetamide?
The InChIKey is UZGWSNZVDWYTCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H26N4O3/c31-23(19-20-13-16-27-17-14-20)28-15-7-8-18-30-24(32)26(29-25(30)33,21-9-3-1-4-10-21)22-11-5-2-6-12-22/h1-6,9-14,16-17H,7-8,15,18-19H2,(H,28,31)(H,29,33).
What are the key properties of N-[4-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)butyl]-2-pyridin-4-ylacetamide?
N-[4-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)butyl]-2-pyridin-4-ylacetamide has a molecular weight of 442.52 g/mol, XLogP of 3.02, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)butyl]-2-pyridin-4-ylacetamide is sourced from PubChem (CID 70826266), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).