N-(1-ethyl-6-oxo-3-pyridinyl)-2-piperazin-1-ylacetamide

C13H20N4O2 — CID 54862599

IUPACN-(1-ethyl-6-oxo-3-pyridinyl)-2-piperazin-1-ylacetamide
SMILESCCn1cc(NC(=O)CN2CCNCC2)ccc1=O
InChIInChI=1S/C13H20N4O2/c1-2-17-9-11(3-4-13(17)19)15-12(18)10-16-7-5-14-6-8-16/h3-4,9,14H,2,5-8,10H2,1H3,(H,15,18)
InChIKeyCBTQQNVYFKBDCX-UHFFFAOYSA-N
MW264.33 g/mol
LogP-0.29
Rot. Bonds4

About N-(1-ethyl-6-oxo-3-pyridinyl)-2-piperazin-1-ylacetamide

N-(1-ethyl-6-oxo-3-pyridinyl)-2-piperazin-1-ylacetamide (PubChem CID 54862599) has the molecular formula C13H20N4O2 and a molecular weight of 264.33 g/mol. Its IUPAC name is N-(1-ethyl-6-oxo-3-pyridinyl)-2-piperazin-1-ylacetamide.

Molecular Properties

Compound NameN-(1-ethyl-6-oxo-3-pyridinyl)-2-piperazin-1-ylacetamide
PubChem CID54862599
Molecular FormulaC13H20N4O2
Molecular Weight264.33 g/mol
Exact Mass264.16
IUPAC NameN-(1-ethyl-6-oxo-3-pyridinyl)-2-piperazin-1-ylacetamide
SMILESCCn1cc(NC(=O)CN2CCNCC2)ccc1=O
InChIInChI=1S/C13H20N4O2/c1-2-17-9-11(3-4-13(17)19)15-12(18)10-16-7-5-14-6-8-16/h3-4,9,14H,2,5-8,10H2,1H3,(H,15,18)
InChIKeyCBTQQNVYFKBDCX-UHFFFAOYSA-N
XLogP-0.29
TPSA66.37 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.33
LogP ≤ 5-0.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(1-ethyl-6-oxo-3-pyridinyl)-2-piperazin-1-ylacetamide?
The IUPAC name of N-(1-ethyl-6-oxo-3-pyridinyl)-2-piperazin-1-ylacetamide (CID 54862599) is N-(1-ethyl-6-oxo-3-pyridinyl)-2-piperazin-1-ylacetamide.
What is the SMILES notation for N-(1-ethyl-6-oxo-3-pyridinyl)-2-piperazin-1-ylacetamide?
The canonical SMILES for N-(1-ethyl-6-oxo-3-pyridinyl)-2-piperazin-1-ylacetamide is CCn1cc(NC(=O)CN2CCNCC2)ccc1=O.
What is the InChIKey of N-(1-ethyl-6-oxo-3-pyridinyl)-2-piperazin-1-ylacetamide?
The InChIKey is CBTQQNVYFKBDCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N4O2/c1-2-17-9-11(3-4-13(17)19)15-12(18)10-16-7-5-14-6-8-16/h3-4,9,14H,2,5-8,10H2,1H3,(H,15,18).
What are the key properties of N-(1-ethyl-6-oxo-3-pyridinyl)-2-piperazin-1-ylacetamide?
N-(1-ethyl-6-oxo-3-pyridinyl)-2-piperazin-1-ylacetamide has a molecular weight of 264.33 g/mol, XLogP of -0.29, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-ethyl-6-oxo-3-pyridinyl)-2-piperazin-1-ylacetamide is sourced from PubChem (CID 54862599), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).