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

C9H11N5O3 — CID 43430670

IUPAC2-(3-methyl-2,5-dioxoimidazolidin-1-yl)-N-(1H-pyrazol-4-yl)acetamide
SMILESCN1CC(=O)N(CC(=O)Nc2cn[nH]c2)C1=O
InChIInChI=1S/C9H11N5O3/c1-13-5-8(16)14(9(13)17)4-7(15)12-6-2-10-11-3-6/h2-3H,4-5H2,1H3,(H,10,11)(H,12,15)
InChIKeyXFVJQGMCRIZXFS-UHFFFAOYSA-N
MW237.22 g/mol
LogP-0.76
Rot. Bonds3

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

2-(3-methyl-2,5-dioxoimidazolidin-1-yl)-N-(1H-pyrazol-4-yl)acetamide (PubChem CID 43430670) has the molecular formula C9H11N5O3 and a molecular weight of 237.22 g/mol. Its IUPAC name is 2-(3-methyl-2,5-dioxoimidazolidin-1-yl)-N-(1H-pyrazol-4-yl)acetamide.

Molecular Properties

Compound Name2-(3-methyl-2,5-dioxoimidazolidin-1-yl)-N-(1H-pyrazol-4-yl)acetamide
PubChem CID43430670
Molecular FormulaC9H11N5O3
Molecular Weight237.22 g/mol
Exact Mass237.09
IUPAC Name2-(3-methyl-2,5-dioxoimidazolidin-1-yl)-N-(1H-pyrazol-4-yl)acetamide
SMILESCN1CC(=O)N(CC(=O)Nc2cn[nH]c2)C1=O
InChIInChI=1S/C9H11N5O3/c1-13-5-8(16)14(9(13)17)4-7(15)12-6-2-10-11-3-6/h2-3H,4-5H2,1H3,(H,10,11)(H,12,15)
InChIKeyXFVJQGMCRIZXFS-UHFFFAOYSA-N
XLogP-0.76
TPSA98.40 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.22
LogP ≤ 5-0.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

1-(1H-pyrazol-4-yl)-3-(2-pyrrolidin-1-ylpropyl)urea
CID 71893198
N-methyl-2-[4-(1H-pyrazol-4-ylcarbamoylamino)piperidin-1-yl]acetamide
CID 53503350
1-[2-(dimethylamino)propyl]-3-(1H-pyrazol-4-yl)urea
CID 53505344
1-[2-(4-acetylpiperazin-1-yl)ethyl]-3-(1H-pyrazol-4-yl)urea
CID 71893159
1-(1H-pyrazol-4-yl)-3-(2-pyrrolidin-1-ylbutyl)urea
CID 71893203
(2S)-2-N,2-N-diethyl-1-N-(1H-pyrazol-4-yl)pyrrolidine-1,2-dicarboxamide
CID 95628337
2-[cyclopropyl(ethyl)amino]-N-(1H-pyrazol-4-yl)acetamide
CID 136517020
1-methyl-3-(1H-pyrazol-4-yl)urea
CID 20784637
2-(dimethylamino)-N-(1H-pyrazol-4-yl)acetamide
CID 20784744
2-methyl-N-(1H-pyrazol-4-yl)pyrrolidine-1-carboxamide
CID 20784753
N-(1H-pyrazol-4-yl)pyrrolidine-1-carboxamide
CID 20784959
1,1-dimethyl-3-(1H-pyrazol-4-yl)urea
CID 22478018

Frequently Asked Questions

What is the IUPAC name of 2-(3-methyl-2,5-dioxoimidazolidin-1-yl)-N-(1H-pyrazol-4-yl)acetamide?
The IUPAC name of 2-(3-methyl-2,5-dioxoimidazolidin-1-yl)-N-(1H-pyrazol-4-yl)acetamide (CID 43430670) is 2-(3-methyl-2,5-dioxoimidazolidin-1-yl)-N-(1H-pyrazol-4-yl)acetamide.
What is the SMILES notation for 2-(3-methyl-2,5-dioxoimidazolidin-1-yl)-N-(1H-pyrazol-4-yl)acetamide?
The canonical SMILES for 2-(3-methyl-2,5-dioxoimidazolidin-1-yl)-N-(1H-pyrazol-4-yl)acetamide is CN1CC(=O)N(CC(=O)Nc2cn[nH]c2)C1=O.
What is the InChIKey of 2-(3-methyl-2,5-dioxoimidazolidin-1-yl)-N-(1H-pyrazol-4-yl)acetamide?
The InChIKey is XFVJQGMCRIZXFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N5O3/c1-13-5-8(16)14(9(13)17)4-7(15)12-6-2-10-11-3-6/h2-3H,4-5H2,1H3,(H,10,11)(H,12,15).
What are the key properties of 2-(3-methyl-2,5-dioxoimidazolidin-1-yl)-N-(1H-pyrazol-4-yl)acetamide?
2-(3-methyl-2,5-dioxoimidazolidin-1-yl)-N-(1H-pyrazol-4-yl)acetamide has a molecular weight of 237.22 g/mol, XLogP of -0.76, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methyl-2,5-dioxoimidazolidin-1-yl)-N-(1H-pyrazol-4-yl)acetamide is sourced from PubChem (CID 43430670), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).