N-(4-hydroxypentyl)-2-(3-methyl-2,5-dioxoimidazolidin-1-yl)acetamide

C11H19N3O4 — CID 107299809

IUPACN-(4-hydroxypentyl)-2-(3-methyl-2,5-dioxoimidazolidin-1-yl)acetamide
SMILESCC(O)CCCNC(=O)CN1C(=O)CN(C)C1=O
InChIInChI=1S/C11H19N3O4/c1-8(15)4-3-5-12-9(16)6-14-10(17)7-13(2)11(14)18/h8,15H,3-7H2,1-2H3,(H,12,16)
InChIKeyJHXQWNMDVJADCA-UHFFFAOYSA-N
MW257.29 g/mol
LogP-0.84
Rot. Bonds6

About N-(4-hydroxypentyl)-2-(3-methyl-2,5-dioxoimidazolidin-1-yl)acetamide

N-(4-hydroxypentyl)-2-(3-methyl-2,5-dioxoimidazolidin-1-yl)acetamide (PubChem CID 107299809) has the molecular formula C11H19N3O4 and a molecular weight of 257.29 g/mol. Its IUPAC name is N-(4-hydroxypentyl)-2-(3-methyl-2,5-dioxoimidazolidin-1-yl)acetamide.

Molecular Properties

Compound NameN-(4-hydroxypentyl)-2-(3-methyl-2,5-dioxoimidazolidin-1-yl)acetamide
PubChem CID107299809
Molecular FormulaC11H19N3O4
Molecular Weight257.29 g/mol
Exact Mass257.14
IUPAC NameN-(4-hydroxypentyl)-2-(3-methyl-2,5-dioxoimidazolidin-1-yl)acetamide
SMILESCC(O)CCCNC(=O)CN1C(=O)CN(C)C1=O
InChIInChI=1S/C11H19N3O4/c1-8(15)4-3-5-12-9(16)6-14-10(17)7-13(2)11(14)18/h8,15H,3-7H2,1-2H3,(H,12,16)
InChIKeyJHXQWNMDVJADCA-UHFFFAOYSA-N
XLogP-0.84
TPSA89.95 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.29
LogP ≤ 5-0.84
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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Frequently Asked Questions

What is the IUPAC name of N-(4-hydroxypentyl)-2-(3-methyl-2,5-dioxoimidazolidin-1-yl)acetamide?
The IUPAC name of N-(4-hydroxypentyl)-2-(3-methyl-2,5-dioxoimidazolidin-1-yl)acetamide (CID 107299809) is N-(4-hydroxypentyl)-2-(3-methyl-2,5-dioxoimidazolidin-1-yl)acetamide.
What is the SMILES notation for N-(4-hydroxypentyl)-2-(3-methyl-2,5-dioxoimidazolidin-1-yl)acetamide?
The canonical SMILES for N-(4-hydroxypentyl)-2-(3-methyl-2,5-dioxoimidazolidin-1-yl)acetamide is CC(O)CCCNC(=O)CN1C(=O)CN(C)C1=O.
What is the InChIKey of N-(4-hydroxypentyl)-2-(3-methyl-2,5-dioxoimidazolidin-1-yl)acetamide?
The InChIKey is JHXQWNMDVJADCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O4/c1-8(15)4-3-5-12-9(16)6-14-10(17)7-13(2)11(14)18/h8,15H,3-7H2,1-2H3,(H,12,16).
What are the key properties of N-(4-hydroxypentyl)-2-(3-methyl-2,5-dioxoimidazolidin-1-yl)acetamide?
N-(4-hydroxypentyl)-2-(3-methyl-2,5-dioxoimidazolidin-1-yl)acetamide has a molecular weight of 257.29 g/mol, XLogP of -0.84, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-hydroxypentyl)-2-(3-methyl-2,5-dioxoimidazolidin-1-yl)acetamide is sourced from PubChem (CID 107299809), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).