N-[2-(2,5-dioxoimidazolidin-1-yl)ethyl]-3-phenylbenzamide

C18H17N3O3 — CID 110719117

IUPACN-[2-(2,5-dioxoimidazolidin-1-yl)ethyl]-3-phenylbenzamide
SMILESO=C(NCCN1C(=O)CNC1=O)c1cccc(-c2ccccc2)c1
InChIInChI=1S/C18H17N3O3/c22-16-12-20-18(24)21(16)10-9-19-17(23)15-8-4-7-14(11-15)13-5-2-1-3-6-13/h1-8,11H,9-10,12H2,(H,19,23)(H,20,24)
InChIKeyAVBKHTXOSFVILW-UHFFFAOYSA-N
MW323.35 g/mol
LogP1.64
Rot. Bonds5

About N-[2-(2,5-dioxoimidazolidin-1-yl)ethyl]-3-phenylbenzamide

N-[2-(2,5-dioxoimidazolidin-1-yl)ethyl]-3-phenylbenzamide (PubChem CID 110719117) has the molecular formula C18H17N3O3 and a molecular weight of 323.35 g/mol. Its IUPAC name is N-[2-(2,5-dioxoimidazolidin-1-yl)ethyl]-3-phenylbenzamide.

Molecular Properties

Compound NameN-[2-(2,5-dioxoimidazolidin-1-yl)ethyl]-3-phenylbenzamide
PubChem CID110719117
Molecular FormulaC18H17N3O3
Molecular Weight323.35 g/mol
Exact Mass323.13
IUPAC NameN-[2-(2,5-dioxoimidazolidin-1-yl)ethyl]-3-phenylbenzamide
SMILESO=C(NCCN1C(=O)CNC1=O)c1cccc(-c2ccccc2)c1
InChIInChI=1S/C18H17N3O3/c22-16-12-20-18(24)21(16)10-9-19-17(23)15-8-4-7-14(11-15)13-5-2-1-3-6-13/h1-8,11H,9-10,12H2,(H,19,23)(H,20,24)
InChIKeyAVBKHTXOSFVILW-UHFFFAOYSA-N
XLogP1.64
TPSA78.51 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.35
LogP ≤ 51.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-[2-(2,5-dioxoimidazolidin-1-yl)ethyl]-3-methylbenzamide
CID 110719076
N-[2-(2,5-dioxoimidazolidin-1-yl)ethyl]-2-phenylacetamide
CID 110719095
N-(2-methylsulfanylethyl)-3-phenylbenzamide
CID 67213717
N-[2-(2,5-dioxopyrrolidin-1-yl)ethyl]-3-methylbenzamide
CID 146088463
3-[(2,5-dioxoimidazolidin-1-yl)methyl]-N-(3-piperazin-1-ylpropyl)benzamide;hydrochloride
CID 119393878
N-[2-(2,5-dioxopyrrolidin-1-yl)ethyl]-3-(2-oxochromen-3-yl)benzamide
CID 171914835
(2S,3R)-N-[2-(2,5-dioxoimidazolidin-1-yl)ethyl]-3-methyl-2-phenylpentanamide
CID 95339120
N-[2-(2-methyl-1,3-dioxolan-2-yl)ethyl]-3-phenylbenzamide
CID 110359324
3-phenyl-N-(2-piperidin-1-ylsulfonylethyl)benzamide
CID 110287574
3-(2-fluorophenyl)-N-[2-(2-oxopyrrolidin-1-yl)ethyl]benzamide
CID 50959619
3,4-dimethyl-N-[2-(2-oxo-3H-indol-1-yl)ethyl]benzamide
CID 110730027
1-[2-(2,5-dioxoimidazolidin-1-yl)ethyl]-2-(2-phenylethyl)guanidine
CID 111812529

Frequently Asked Questions

What is the IUPAC name of N-[2-(2,5-dioxoimidazolidin-1-yl)ethyl]-3-phenylbenzamide?
The IUPAC name of N-[2-(2,5-dioxoimidazolidin-1-yl)ethyl]-3-phenylbenzamide (CID 110719117) is N-[2-(2,5-dioxoimidazolidin-1-yl)ethyl]-3-phenylbenzamide.
What is the SMILES notation for N-[2-(2,5-dioxoimidazolidin-1-yl)ethyl]-3-phenylbenzamide?
The canonical SMILES for N-[2-(2,5-dioxoimidazolidin-1-yl)ethyl]-3-phenylbenzamide is O=C(NCCN1C(=O)CNC1=O)c1cccc(-c2ccccc2)c1.
What is the InChIKey of N-[2-(2,5-dioxoimidazolidin-1-yl)ethyl]-3-phenylbenzamide?
The InChIKey is AVBKHTXOSFVILW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17N3O3/c22-16-12-20-18(24)21(16)10-9-19-17(23)15-8-4-7-14(11-15)13-5-2-1-3-6-13/h1-8,11H,9-10,12H2,(H,19,23)(H,20,24).
What are the key properties of N-[2-(2,5-dioxoimidazolidin-1-yl)ethyl]-3-phenylbenzamide?
N-[2-(2,5-dioxoimidazolidin-1-yl)ethyl]-3-phenylbenzamide has a molecular weight of 323.35 g/mol, XLogP of 1.64, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2,5-dioxoimidazolidin-1-yl)ethyl]-3-phenylbenzamide is sourced from PubChem (CID 110719117), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).