N-(2-oxo-2-piperazin-1-ylethyl)-2-pyridin-2-ylacetamide

C13H18N4O2 — CID 61174926

IUPACN-(2-oxo-2-piperazin-1-ylethyl)-2-pyridin-2-ylacetamide
SMILESO=C(Cc1ccccn1)NCC(=O)N1CCNCC1
InChIInChI=1S/C13H18N4O2/c18-12(9-11-3-1-2-4-15-11)16-10-13(19)17-7-5-14-6-8-17/h1-4,14H,5-10H2,(H,16,18)
InChIKeyGUFGPKPWCJIKNI-UHFFFAOYSA-N
MW262.31 g/mol
LogP-0.83
Rot. Bonds4

About N-(2-oxo-2-piperazin-1-ylethyl)-2-pyridin-2-ylacetamide

N-(2-oxo-2-piperazin-1-ylethyl)-2-pyridin-2-ylacetamide (PubChem CID 61174926) has the molecular formula C13H18N4O2 and a molecular weight of 262.31 g/mol. Its IUPAC name is N-(2-oxo-2-piperazin-1-ylethyl)-2-pyridin-2-ylacetamide.

Molecular Properties

Compound NameN-(2-oxo-2-piperazin-1-ylethyl)-2-pyridin-2-ylacetamide
PubChem CID61174926
Molecular FormulaC13H18N4O2
Molecular Weight262.31 g/mol
Exact Mass262.14
IUPAC NameN-(2-oxo-2-piperazin-1-ylethyl)-2-pyridin-2-ylacetamide
SMILESO=C(Cc1ccccn1)NCC(=O)N1CCNCC1
InChIInChI=1S/C13H18N4O2/c18-12(9-11-3-1-2-4-15-11)16-10-13(19)17-7-5-14-6-8-17/h1-4,14H,5-10H2,(H,16,18)
InChIKeyGUFGPKPWCJIKNI-UHFFFAOYSA-N
XLogP-0.83
TPSA74.33 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.31
LogP ≤ 5-0.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(2-oxo-2-piperazin-1-ylethyl)-2-pyridin-2-ylacetamide?
The IUPAC name of N-(2-oxo-2-piperazin-1-ylethyl)-2-pyridin-2-ylacetamide (CID 61174926) is N-(2-oxo-2-piperazin-1-ylethyl)-2-pyridin-2-ylacetamide.
What is the SMILES notation for N-(2-oxo-2-piperazin-1-ylethyl)-2-pyridin-2-ylacetamide?
The canonical SMILES for N-(2-oxo-2-piperazin-1-ylethyl)-2-pyridin-2-ylacetamide is O=C(Cc1ccccn1)NCC(=O)N1CCNCC1.
What is the InChIKey of N-(2-oxo-2-piperazin-1-ylethyl)-2-pyridin-2-ylacetamide?
The InChIKey is GUFGPKPWCJIKNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N4O2/c18-12(9-11-3-1-2-4-15-11)16-10-13(19)17-7-5-14-6-8-17/h1-4,14H,5-10H2,(H,16,18).
What are the key properties of N-(2-oxo-2-piperazin-1-ylethyl)-2-pyridin-2-ylacetamide?
N-(2-oxo-2-piperazin-1-ylethyl)-2-pyridin-2-ylacetamide has a molecular weight of 262.31 g/mol, XLogP of -0.83, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-oxo-2-piperazin-1-ylethyl)-2-pyridin-2-ylacetamide is sourced from PubChem (CID 61174926), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).