2-(4-cyclopentyl-3-oxopiperazin-1-yl)-N-(1-methylpyrazol-3-yl)acetamide

C15H23N5O2 — CID 46981191

IUPAC2-(4-cyclopentyl-3-oxopiperazin-1-yl)-N-(1-methylpyrazol-3-yl)acetamide
SMILESCn1ccc(NC(=O)CN2CCN(C3CCCC3)C(=O)C2)n1
InChIInChI=1S/C15H23N5O2/c1-18-7-6-13(17-18)16-14(21)10-19-8-9-20(15(22)11-19)12-4-2-3-5-12/h6-7,12H,2-5,8-11H2,1H3,(H,16,17,21)
InChIKeyJIRLUNHYLHTTIA-UHFFFAOYSA-N
MW305.38 g/mol
LogP0.45
Rot. Bonds4

About 2-(4-cyclopentyl-3-oxopiperazin-1-yl)-N-(1-methylpyrazol-3-yl)acetamide

2-(4-cyclopentyl-3-oxopiperazin-1-yl)-N-(1-methylpyrazol-3-yl)acetamide (PubChem CID 46981191) has the molecular formula C15H23N5O2 and a molecular weight of 305.38 g/mol. Its IUPAC name is 2-(4-cyclopentyl-3-oxopiperazin-1-yl)-N-(1-methylpyrazol-3-yl)acetamide.

Molecular Properties

Compound Name2-(4-cyclopentyl-3-oxopiperazin-1-yl)-N-(1-methylpyrazol-3-yl)acetamide
PubChem CID46981191
Molecular FormulaC15H23N5O2
Molecular Weight305.38 g/mol
Exact Mass305.19
IUPAC Name2-(4-cyclopentyl-3-oxopiperazin-1-yl)-N-(1-methylpyrazol-3-yl)acetamide
SMILESCn1ccc(NC(=O)CN2CCN(C3CCCC3)C(=O)C2)n1
InChIInChI=1S/C15H23N5O2/c1-18-7-6-13(17-18)16-14(21)10-19-8-9-20(15(22)11-19)12-4-2-3-5-12/h6-7,12H,2-5,8-11H2,1H3,(H,16,17,21)
InChIKeyJIRLUNHYLHTTIA-UHFFFAOYSA-N
XLogP0.45
TPSA70.47 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.38
LogP ≤ 50.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(4-cyclopentyl-3-oxopiperazin-1-yl)-N-(1-methylpyrazol-3-yl)acetamide?
The IUPAC name of 2-(4-cyclopentyl-3-oxopiperazin-1-yl)-N-(1-methylpyrazol-3-yl)acetamide (CID 46981191) is 2-(4-cyclopentyl-3-oxopiperazin-1-yl)-N-(1-methylpyrazol-3-yl)acetamide.
What is the SMILES notation for 2-(4-cyclopentyl-3-oxopiperazin-1-yl)-N-(1-methylpyrazol-3-yl)acetamide?
The canonical SMILES for 2-(4-cyclopentyl-3-oxopiperazin-1-yl)-N-(1-methylpyrazol-3-yl)acetamide is Cn1ccc(NC(=O)CN2CCN(C3CCCC3)C(=O)C2)n1.
What is the InChIKey of 2-(4-cyclopentyl-3-oxopiperazin-1-yl)-N-(1-methylpyrazol-3-yl)acetamide?
The InChIKey is JIRLUNHYLHTTIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N5O2/c1-18-7-6-13(17-18)16-14(21)10-19-8-9-20(15(22)11-19)12-4-2-3-5-12/h6-7,12H,2-5,8-11H2,1H3,(H,16,17,21).
What are the key properties of 2-(4-cyclopentyl-3-oxopiperazin-1-yl)-N-(1-methylpyrazol-3-yl)acetamide?
2-(4-cyclopentyl-3-oxopiperazin-1-yl)-N-(1-methylpyrazol-3-yl)acetamide has a molecular weight of 305.38 g/mol, XLogP of 0.45, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-cyclopentyl-3-oxopiperazin-1-yl)-N-(1-methylpyrazol-3-yl)acetamide is sourced from PubChem (CID 46981191), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).