2-amino-5-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)pentanoic acid

C20H21N3O4 — CID 3084726

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IUPAC2-amino-5-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)pentanoic acid
SMILESNC(CCCN1C(=O)NC(c2ccccc2)(c2ccccc2)C1=O)C(=O)O
InChIInChI=1S/C20H21N3O4/c21-16(17(24)25)12-7-13-23-18(26)20(22-19(23)27,14-8-3-1-4-9-14)15-10-5-2-6-11-15/h1-6,8-11,16H,7,12-13,21H2,(H,22,27)(H,24,25)
InChIKeyPAJBBDCZSMDSFL-UHFFFAOYSA-N
MW367.41 g/mol
LogP1.67
Rot. Bonds7

About 2-amino-5-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)pentanoic acid

2-amino-5-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)pentanoic acid (PubChem CID 3084726) has the molecular formula C20H21N3O4 and a molecular weight of 367.41 g/mol. Its IUPAC name is 2-amino-5-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)pentanoic acid.

Molecular Properties

Compound Name2-amino-5-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)pentanoic acid
PubChem CID3084726
Molecular FormulaC20H21N3O4
Molecular Weight367.41 g/mol
Exact Mass367.15
IUPAC Name2-amino-5-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)pentanoic acid
SMILESNC(CCCN1C(=O)NC(c2ccccc2)(c2ccccc2)C1=O)C(=O)O
InChIInChI=1S/C20H21N3O4/c21-16(17(24)25)12-7-13-23-18(26)20(22-19(23)27,14-8-3-1-4-9-14)15-10-5-2-6-11-15/h1-6,8-11,16H,7,12-13,21H2,(H,22,27)(H,24,25)
InChIKeyPAJBBDCZSMDSFL-UHFFFAOYSA-N
XLogP1.67
TPSA112.73 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.41
LogP ≤ 51.67
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'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
S-[(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)methyl] 2-aminoethanethioate
CID 54266354
5,5-diphenyl-3-(4-phenylsulfanylbutyl)imidazolidine-2,4-dione
CID 2221675
5,5-diphenyl-3-[2-(propan-2-ylamino)ethyl]imidazolidine-2,4-dione
CID 129132203
N-[4-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)butyl]-2-pyridin-4-ylacetamide
CID 70826266
3-[3-(4-isocyano-4-phenylpiperidin-1-yl)propyl]-5,5-diphenylimidazolidine-2,4-dione
CID 22960997
ethyl 2-[2-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)ethoxy]acetate
CID 75425557
benzyl 4-[5-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)pentanoyl]piperazine-1-carboxylate
CID 19975176
1-[3-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)propyl]-4-phenylpiperidine-4-carbonitrile
CID 10299367
2-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)-N-(6-methylheptan-2-yl)acetamide
CID 46606290
3-[(2R)-2-(4-fluorophenyl)-2-hydroxyethyl]-5,5-diphenylimidazolidine-2,4-dione
CID 32519552

Frequently Asked Questions

What is the IUPAC name of 2-amino-5-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)pentanoic acid?
The IUPAC name of 2-amino-5-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)pentanoic acid (CID 3084726) is 2-amino-5-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)pentanoic acid.
What is the SMILES notation for 2-amino-5-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)pentanoic acid?
The canonical SMILES for 2-amino-5-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)pentanoic acid is NC(CCCN1C(=O)NC(c2ccccc2)(c2ccccc2)C1=O)C(=O)O.
What is the InChIKey of 2-amino-5-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)pentanoic acid?
The InChIKey is PAJBBDCZSMDSFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21N3O4/c21-16(17(24)25)12-7-13-23-18(26)20(22-19(23)27,14-8-3-1-4-9-14)15-10-5-2-6-11-15/h1-6,8-11,16H,7,12-13,21H2,(H,22,27)(H,24,25).
What are the key properties of 2-amino-5-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)pentanoic acid?
2-amino-5-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)pentanoic acid has a molecular weight of 367.41 g/mol, XLogP of 1.67, 7 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-5-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)pentanoic acid is sourced from PubChem (CID 3084726), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).