2-(2,5-dioxoimidazolidin-4-yl)-N-(1H-indazol-6-yl)acetamide

C12H11N5O3 — CID 110698557

IUPAC2-(2,5-dioxoimidazolidin-4-yl)-N-(1H-indazol-6-yl)acetamide
SMILESO=C(CC1NC(=O)NC1=O)Nc1ccc2cn[nH]c2c1
InChIInChI=1S/C12H11N5O3/c18-10(4-9-11(19)16-12(20)15-9)14-7-2-1-6-5-13-17-8(6)3-7/h1-3,5,9H,4H2,(H,13,17)(H,14,18)(H2,15,16,19,20)
InChIKeyWCUZGYVZTRUZMU-UHFFFAOYSA-N
MW273.25 g/mol
LogP0.10
Rot. Bonds3

About 2-(2,5-dioxoimidazolidin-4-yl)-N-(1H-indazol-6-yl)acetamide

2-(2,5-dioxoimidazolidin-4-yl)-N-(1H-indazol-6-yl)acetamide (PubChem CID 110698557) has the molecular formula C12H11N5O3 and a molecular weight of 273.25 g/mol. Its IUPAC name is 2-(2,5-dioxoimidazolidin-4-yl)-N-(1H-indazol-6-yl)acetamide.

Molecular Properties

Compound Name2-(2,5-dioxoimidazolidin-4-yl)-N-(1H-indazol-6-yl)acetamide
PubChem CID110698557
Molecular FormulaC12H11N5O3
Molecular Weight273.25 g/mol
Exact Mass273.09
IUPAC Name2-(2,5-dioxoimidazolidin-4-yl)-N-(1H-indazol-6-yl)acetamide
SMILESO=C(CC1NC(=O)NC1=O)Nc1ccc2cn[nH]c2c1
InChIInChI=1S/C12H11N5O3/c18-10(4-9-11(19)16-12(20)15-9)14-7-2-1-6-5-13-17-8(6)3-7/h1-3,5,9H,4H2,(H,13,17)(H,14,18)(H2,15,16,19,20)
InChIKeyWCUZGYVZTRUZMU-UHFFFAOYSA-N
XLogP0.10
TPSA115.98 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.25
LogP ≤ 50.10
H-Bond Donors ≤ 54
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 2-(2,5-dioxoimidazolidin-4-yl)-N-(1H-indazol-6-yl)acetamide?
The IUPAC name of 2-(2,5-dioxoimidazolidin-4-yl)-N-(1H-indazol-6-yl)acetamide (CID 110698557) is 2-(2,5-dioxoimidazolidin-4-yl)-N-(1H-indazol-6-yl)acetamide.
What is the SMILES notation for 2-(2,5-dioxoimidazolidin-4-yl)-N-(1H-indazol-6-yl)acetamide?
The canonical SMILES for 2-(2,5-dioxoimidazolidin-4-yl)-N-(1H-indazol-6-yl)acetamide is O=C(CC1NC(=O)NC1=O)Nc1ccc2cn[nH]c2c1.
What is the InChIKey of 2-(2,5-dioxoimidazolidin-4-yl)-N-(1H-indazol-6-yl)acetamide?
The InChIKey is WCUZGYVZTRUZMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11N5O3/c18-10(4-9-11(19)16-12(20)15-9)14-7-2-1-6-5-13-17-8(6)3-7/h1-3,5,9H,4H2,(H,13,17)(H,14,18)(H2,15,16,19,20).
What are the key properties of 2-(2,5-dioxoimidazolidin-4-yl)-N-(1H-indazol-6-yl)acetamide?
2-(2,5-dioxoimidazolidin-4-yl)-N-(1H-indazol-6-yl)acetamide has a molecular weight of 273.25 g/mol, XLogP of 0.10, 3 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-dioxoimidazolidin-4-yl)-N-(1H-indazol-6-yl)acetamide is sourced from PubChem (CID 110698557), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).