4-(2,4-dioxoimidazolidin-1-yl)-N-[2-(5-propan-2-yl-1,2,4-oxadiazol-3-yl)ethyl]benzamide

C17H19N5O4 — CID 118764526

IUPAC4-(2,4-dioxoimidazolidin-1-yl)-N-[2-(5-propan-2-yl-1,2,4-oxadiazol-3-yl)ethyl]benzamide
SMILESCC(C)c1nc(CCNC(=O)c2ccc(N3CC(=O)NC3=O)cc2)no1
InChIInChI=1S/C17H19N5O4/c1-10(2)16-19-13(21-26-16)7-8-18-15(24)11-3-5-12(6-4-11)22-9-14(23)20-17(22)25/h3-6,10H,7-9H2,1-2H3,(H,18,24)(H,20,23,25)
InChIKeyOMXDCMZUCVDQJU-UHFFFAOYSA-N
MW357.37 g/mol
LogP1.22
Rot. Bonds6

About 4-(2,4-dioxoimidazolidin-1-yl)-N-[2-(5-propan-2-yl-1,2,4-oxadiazol-3-yl)ethyl]benzamide

4-(2,4-dioxoimidazolidin-1-yl)-N-[2-(5-propan-2-yl-1,2,4-oxadiazol-3-yl)ethyl]benzamide (PubChem CID 118764526) has the molecular formula C17H19N5O4 and a molecular weight of 357.37 g/mol. Its IUPAC name is 4-(2,4-dioxoimidazolidin-1-yl)-N-[2-(5-propan-2-yl-1,2,4-oxadiazol-3-yl)ethyl]benzamide.

Molecular Properties

Compound Name4-(2,4-dioxoimidazolidin-1-yl)-N-[2-(5-propan-2-yl-1,2,4-oxadiazol-3-yl)ethyl]benzamide
PubChem CID118764526
Molecular FormulaC17H19N5O4
Molecular Weight357.37 g/mol
Exact Mass357.14
IUPAC Name4-(2,4-dioxoimidazolidin-1-yl)-N-[2-(5-propan-2-yl-1,2,4-oxadiazol-3-yl)ethyl]benzamide
SMILESCC(C)c1nc(CCNC(=O)c2ccc(N3CC(=O)NC3=O)cc2)no1
InChIInChI=1S/C17H19N5O4/c1-10(2)16-19-13(21-26-16)7-8-18-15(24)11-3-5-12(6-4-11)22-9-14(23)20-17(22)25/h3-6,10H,7-9H2,1-2H3,(H,18,24)(H,20,23,25)
InChIKeyOMXDCMZUCVDQJU-UHFFFAOYSA-N
XLogP1.22
TPSA117.43 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.37
LogP ≤ 51.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

N-[2-(2-amino-1,3-thiazol-4-yl)ethyl]-4-(2,4-dioxoimidazolidin-1-yl)benzamide
CID 72897828
4-(2,4-dioxoimidazolidin-1-yl)-N-[2-[(4-methyl-1,2,5-oxadiazol-3-yl)oxy]ethyl]benzamide
CID 72852410
5-chloro-6-oxo-N-[2-(5-propan-2-yl-1,2,4-oxadiazol-3-yl)ethyl]-1H-pyridine-3-carboxamide
CID 118784140
N-[2-(5-tert-butyl-1,2,4-oxadiazol-3-yl)ethyl]-4-(2-oxopyrrolidin-1-yl)benzamide
CID 110311084
4-(2,4-dioxoimidazolidin-1-yl)-N-[(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)methyl]benzamide
CID 72888492
4-(2,4-dioxoimidazolidin-1-yl)-N-[(5-methylpyrazin-2-yl)methyl]benzamide
CID 74231577
4-(2,4-dioxoimidazolidin-1-yl)-N-[(2R)-1-pyridin-3-ylpropan-2-yl]benzamide
CID 97203237
1-(4-aminocyclohexyl)-N-[2-(5-propan-2-yl-1,2,4-oxadiazol-3-yl)ethyl]triazole-4-carboxamide
CID 70742026
5-(5-methylfuran-2-yl)-N-[2-(5-propan-2-yl-1,2,4-oxadiazol-3-yl)ethyl]-1H-pyrazole-3-carboxamide
CID 118780006
N-(3-aminobutyl)-4-(2-oxoimidazolidin-1-yl)benzamide
CID 119497450
3-(2-methyl-6-oxo-1-pyridinyl)-N-[2-(5-propan-2-yl-1,2,4-oxadiazol-3-yl)ethyl]propanamide
CID 118774071
N-(3,4-dihydro-2H-chromen-6-ylmethyl)-4-(2,4-dioxoimidazolidin-1-yl)benzamide
CID 72922585

Frequently Asked Questions

What is the IUPAC name of 4-(2,4-dioxoimidazolidin-1-yl)-N-[2-(5-propan-2-yl-1,2,4-oxadiazol-3-yl)ethyl]benzamide?
The IUPAC name of 4-(2,4-dioxoimidazolidin-1-yl)-N-[2-(5-propan-2-yl-1,2,4-oxadiazol-3-yl)ethyl]benzamide (CID 118764526) is 4-(2,4-dioxoimidazolidin-1-yl)-N-[2-(5-propan-2-yl-1,2,4-oxadiazol-3-yl)ethyl]benzamide.
What is the SMILES notation for 4-(2,4-dioxoimidazolidin-1-yl)-N-[2-(5-propan-2-yl-1,2,4-oxadiazol-3-yl)ethyl]benzamide?
The canonical SMILES for 4-(2,4-dioxoimidazolidin-1-yl)-N-[2-(5-propan-2-yl-1,2,4-oxadiazol-3-yl)ethyl]benzamide is CC(C)c1nc(CCNC(=O)c2ccc(N3CC(=O)NC3=O)cc2)no1.
What is the InChIKey of 4-(2,4-dioxoimidazolidin-1-yl)-N-[2-(5-propan-2-yl-1,2,4-oxadiazol-3-yl)ethyl]benzamide?
The InChIKey is OMXDCMZUCVDQJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N5O4/c1-10(2)16-19-13(21-26-16)7-8-18-15(24)11-3-5-12(6-4-11)22-9-14(23)20-17(22)25/h3-6,10H,7-9H2,1-2H3,(H,18,24)(H,20,23,25).
What are the key properties of 4-(2,4-dioxoimidazolidin-1-yl)-N-[2-(5-propan-2-yl-1,2,4-oxadiazol-3-yl)ethyl]benzamide?
4-(2,4-dioxoimidazolidin-1-yl)-N-[2-(5-propan-2-yl-1,2,4-oxadiazol-3-yl)ethyl]benzamide has a molecular weight of 357.37 g/mol, XLogP of 1.22, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,4-dioxoimidazolidin-1-yl)-N-[2-(5-propan-2-yl-1,2,4-oxadiazol-3-yl)ethyl]benzamide is sourced from PubChem (CID 118764526), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).