2-[(4R)-2,5-dioxo-1-propylimidazolidin-4-yl]-N-[2-[(4-methyl-1,2,5-oxadiazol-3-yl)oxy]ethyl]acetamide

C13H19N5O5 — CID 99941492

IUPAC2-[(4R)-2,5-dioxo-1-propylimidazolidin-4-yl]-N-[2-[(4-methyl-1,2,5-oxadiazol-3-yl)oxy]ethyl]acetamide
SMILESCCCN1C(=O)N[C@H](CC(=O)NCCOc2nonc2C)C1=O
InChIInChI=1S/C13H19N5O5/c1-3-5-18-12(20)9(15-13(18)21)7-10(19)14-4-6-22-11-8(2)16-23-17-11/h9H,3-7H2,1-2H3,(H,14,19)(H,15,21)/t9-/m1/s1
InChIKeyIGVKYQNCHMNLTR-SECBINFHSA-N
MW325.33 g/mol
LogP-0.41
Rot. Bonds8

About 2-[(4R)-2,5-dioxo-1-propylimidazolidin-4-yl]-N-[2-[(4-methyl-1,2,5-oxadiazol-3-yl)oxy]ethyl]acetamide

2-[(4R)-2,5-dioxo-1-propylimidazolidin-4-yl]-N-[2-[(4-methyl-1,2,5-oxadiazol-3-yl)oxy]ethyl]acetamide (PubChem CID 99941492) has the molecular formula C13H19N5O5 and a molecular weight of 325.33 g/mol. Its IUPAC name is 2-[(4R)-2,5-dioxo-1-propylimidazolidin-4-yl]-N-[2-[(4-methyl-1,2,5-oxadiazol-3-yl)oxy]ethyl]acetamide.

Molecular Properties

Compound Name2-[(4R)-2,5-dioxo-1-propylimidazolidin-4-yl]-N-[2-[(4-methyl-1,2,5-oxadiazol-3-yl)oxy]ethyl]acetamide
PubChem CID99941492
Molecular FormulaC13H19N5O5
Molecular Weight325.33 g/mol
Exact Mass325.14
IUPAC Name2-[(4R)-2,5-dioxo-1-propylimidazolidin-4-yl]-N-[2-[(4-methyl-1,2,5-oxadiazol-3-yl)oxy]ethyl]acetamide
SMILESCCCN1C(=O)N[C@H](CC(=O)NCCOc2nonc2C)C1=O
InChIInChI=1S/C13H19N5O5/c1-3-5-18-12(20)9(15-13(18)21)7-10(19)14-4-6-22-11-8(2)16-23-17-11/h9H,3-7H2,1-2H3,(H,14,19)(H,15,21)/t9-/m1/s1
InChIKeyIGVKYQNCHMNLTR-SECBINFHSA-N
XLogP-0.41
TPSA126.66 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds8
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.33
LogP ≤ 5-0.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-[(4R)-2,5-dioxo-1-propylimidazolidin-4-yl]-N-[2-[(4-methyl-1,2,5-oxadiazol-3-yl)oxy]ethyl]acetamide?
The IUPAC name of 2-[(4R)-2,5-dioxo-1-propylimidazolidin-4-yl]-N-[2-[(4-methyl-1,2,5-oxadiazol-3-yl)oxy]ethyl]acetamide (CID 99941492) is 2-[(4R)-2,5-dioxo-1-propylimidazolidin-4-yl]-N-[2-[(4-methyl-1,2,5-oxadiazol-3-yl)oxy]ethyl]acetamide.
What is the SMILES notation for 2-[(4R)-2,5-dioxo-1-propylimidazolidin-4-yl]-N-[2-[(4-methyl-1,2,5-oxadiazol-3-yl)oxy]ethyl]acetamide?
The canonical SMILES for 2-[(4R)-2,5-dioxo-1-propylimidazolidin-4-yl]-N-[2-[(4-methyl-1,2,5-oxadiazol-3-yl)oxy]ethyl]acetamide is CCCN1C(=O)N[C@H](CC(=O)NCCOc2nonc2C)C1=O.
What is the InChIKey of 2-[(4R)-2,5-dioxo-1-propylimidazolidin-4-yl]-N-[2-[(4-methyl-1,2,5-oxadiazol-3-yl)oxy]ethyl]acetamide?
The InChIKey is IGVKYQNCHMNLTR-SECBINFHSA-N. The full InChI is InChI=1S/C13H19N5O5/c1-3-5-18-12(20)9(15-13(18)21)7-10(19)14-4-6-22-11-8(2)16-23-17-11/h9H,3-7H2,1-2H3,(H,14,19)(H,15,21)/t9-/m1/s1.
What are the key properties of 2-[(4R)-2,5-dioxo-1-propylimidazolidin-4-yl]-N-[2-[(4-methyl-1,2,5-oxadiazol-3-yl)oxy]ethyl]acetamide?
2-[(4R)-2,5-dioxo-1-propylimidazolidin-4-yl]-N-[2-[(4-methyl-1,2,5-oxadiazol-3-yl)oxy]ethyl]acetamide has a molecular weight of 325.33 g/mol, XLogP of -0.41, 8 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4R)-2,5-dioxo-1-propylimidazolidin-4-yl]-N-[2-[(4-methyl-1,2,5-oxadiazol-3-yl)oxy]ethyl]acetamide is sourced from PubChem (CID 99941492), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).