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

C9H15N3O4 — CID 43419313

IUPACN-(2-hydroxypropyl)-2-(3-methyl-2,5-dioxoimidazolidin-1-yl)acetamide
SMILESCC(O)CNC(=O)CN1C(=O)CN(C)C1=O
InChIInChI=1S/C9H15N3O4/c1-6(13)3-10-7(14)4-12-8(15)5-11(2)9(12)16/h6,13H,3-5H2,1-2H3,(H,10,14)
InChIKeyTWTZXTBUPNQZEF-UHFFFAOYSA-N
MW229.24 g/mol
LogP-1.62
Rot. Bonds4

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

N-(2-hydroxypropyl)-2-(3-methyl-2,5-dioxoimidazolidin-1-yl)acetamide (PubChem CID 43419313) has the molecular formula C9H15N3O4 and a molecular weight of 229.24 g/mol. Its IUPAC name is N-(2-hydroxypropyl)-2-(3-methyl-2,5-dioxoimidazolidin-1-yl)acetamide.

Molecular Properties

Compound NameN-(2-hydroxypropyl)-2-(3-methyl-2,5-dioxoimidazolidin-1-yl)acetamide
PubChem CID43419313
Molecular FormulaC9H15N3O4
Molecular Weight229.24 g/mol
Exact Mass229.11
IUPAC NameN-(2-hydroxypropyl)-2-(3-methyl-2,5-dioxoimidazolidin-1-yl)acetamide
SMILESCC(O)CNC(=O)CN1C(=O)CN(C)C1=O
InChIInChI=1S/C9H15N3O4/c1-6(13)3-10-7(14)4-12-8(15)5-11(2)9(12)16/h6,13H,3-5H2,1-2H3,(H,10,14)
InChIKeyTWTZXTBUPNQZEF-UHFFFAOYSA-N
XLogP-1.62
TPSA89.95 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.24
LogP ≤ 5-1.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxypropyl)-2-(3-methyl-2,5-dioxoimidazolidin-1-yl)acetamide?
The IUPAC name of N-(2-hydroxypropyl)-2-(3-methyl-2,5-dioxoimidazolidin-1-yl)acetamide (CID 43419313) is N-(2-hydroxypropyl)-2-(3-methyl-2,5-dioxoimidazolidin-1-yl)acetamide.
What is the SMILES notation for N-(2-hydroxypropyl)-2-(3-methyl-2,5-dioxoimidazolidin-1-yl)acetamide?
The canonical SMILES for N-(2-hydroxypropyl)-2-(3-methyl-2,5-dioxoimidazolidin-1-yl)acetamide is CC(O)CNC(=O)CN1C(=O)CN(C)C1=O.
What is the InChIKey of N-(2-hydroxypropyl)-2-(3-methyl-2,5-dioxoimidazolidin-1-yl)acetamide?
The InChIKey is TWTZXTBUPNQZEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3O4/c1-6(13)3-10-7(14)4-12-8(15)5-11(2)9(12)16/h6,13H,3-5H2,1-2H3,(H,10,14).
What are the key properties of N-(2-hydroxypropyl)-2-(3-methyl-2,5-dioxoimidazolidin-1-yl)acetamide?
N-(2-hydroxypropyl)-2-(3-methyl-2,5-dioxoimidazolidin-1-yl)acetamide has a molecular weight of 229.24 g/mol, XLogP of -1.62, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxypropyl)-2-(3-methyl-2,5-dioxoimidazolidin-1-yl)acetamide is sourced from PubChem (CID 43419313), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).