2-(2,5-dioxo-4,4-dipropylimidazolidin-1-yl)-N-(1-methylpyrazol-3-yl)acetamide

C15H23N5O3 — CID 35966327

IUPAC2-(2,5-dioxo-4,4-dipropylimidazolidin-1-yl)-N-(1-methylpyrazol-3-yl)acetamide
SMILESCCCC1(CCC)NC(=O)N(CC(=O)Nc2ccn(C)n2)C1=O
InChIInChI=1S/C15H23N5O3/c1-4-7-15(8-5-2)13(22)20(14(23)17-15)10-12(21)16-11-6-9-19(3)18-11/h6,9H,4-5,7-8,10H2,1-3H3,(H,17,23)(H,16,18,21)
InChIKeyLQIAALPOLRRABP-UHFFFAOYSA-N
MW321.38 g/mol
LogP1.25
Rot. Bonds7

About 2-(2,5-dioxo-4,4-dipropylimidazolidin-1-yl)-N-(1-methylpyrazol-3-yl)acetamide

2-(2,5-dioxo-4,4-dipropylimidazolidin-1-yl)-N-(1-methylpyrazol-3-yl)acetamide (PubChem CID 35966327) has the molecular formula C15H23N5O3 and a molecular weight of 321.38 g/mol. Its IUPAC name is 2-(2,5-dioxo-4,4-dipropylimidazolidin-1-yl)-N-(1-methylpyrazol-3-yl)acetamide.

Molecular Properties

Compound Name2-(2,5-dioxo-4,4-dipropylimidazolidin-1-yl)-N-(1-methylpyrazol-3-yl)acetamide
PubChem CID35966327
Molecular FormulaC15H23N5O3
Molecular Weight321.38 g/mol
Exact Mass321.18
IUPAC Name2-(2,5-dioxo-4,4-dipropylimidazolidin-1-yl)-N-(1-methylpyrazol-3-yl)acetamide
SMILESCCCC1(CCC)NC(=O)N(CC(=O)Nc2ccn(C)n2)C1=O
InChIInChI=1S/C15H23N5O3/c1-4-7-15(8-5-2)13(22)20(14(23)17-15)10-12(21)16-11-6-9-19(3)18-11/h6,9H,4-5,7-8,10H2,1-3H3,(H,17,23)(H,16,18,21)
InChIKeyLQIAALPOLRRABP-UHFFFAOYSA-N
XLogP1.25
TPSA96.33 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.38
LogP ≤ 51.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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-dioxo-4,4-dipropylimidazolidin-1-yl)-N-(1-methylpyrazol-3-yl)acetamide?
The IUPAC name of 2-(2,5-dioxo-4,4-dipropylimidazolidin-1-yl)-N-(1-methylpyrazol-3-yl)acetamide (CID 35966327) is 2-(2,5-dioxo-4,4-dipropylimidazolidin-1-yl)-N-(1-methylpyrazol-3-yl)acetamide.
What is the SMILES notation for 2-(2,5-dioxo-4,4-dipropylimidazolidin-1-yl)-N-(1-methylpyrazol-3-yl)acetamide?
The canonical SMILES for 2-(2,5-dioxo-4,4-dipropylimidazolidin-1-yl)-N-(1-methylpyrazol-3-yl)acetamide is CCCC1(CCC)NC(=O)N(CC(=O)Nc2ccn(C)n2)C1=O.
What is the InChIKey of 2-(2,5-dioxo-4,4-dipropylimidazolidin-1-yl)-N-(1-methylpyrazol-3-yl)acetamide?
The InChIKey is LQIAALPOLRRABP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N5O3/c1-4-7-15(8-5-2)13(22)20(14(23)17-15)10-12(21)16-11-6-9-19(3)18-11/h6,9H,4-5,7-8,10H2,1-3H3,(H,17,23)(H,16,18,21).
What are the key properties of 2-(2,5-dioxo-4,4-dipropylimidazolidin-1-yl)-N-(1-methylpyrazol-3-yl)acetamide?
2-(2,5-dioxo-4,4-dipropylimidazolidin-1-yl)-N-(1-methylpyrazol-3-yl)acetamide has a molecular weight of 321.38 g/mol, XLogP of 1.25, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-dioxo-4,4-dipropylimidazolidin-1-yl)-N-(1-methylpyrazol-3-yl)acetamide is sourced from PubChem (CID 35966327), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).