4-[6-(ethylamino)-2-pyridinyl]piperazin-2-one

C11H16N4O — CID 80763941

IUPAC4-[6-(ethylamino)-2-pyridinyl]piperazin-2-one
SMILESCCNc1cccc(N2CCNC(=O)C2)n1
InChIInChI=1S/C11H16N4O/c1-2-12-9-4-3-5-10(14-9)15-7-6-13-11(16)8-15/h3-5H,2,6-8H2,1H3,(H,12,14)(H,13,16)
InChIKeyIPSAYOCGCSSTFN-UHFFFAOYSA-N
MW220.28 g/mol
LogP0.45
Rot. Bonds3

About 4-[6-(ethylamino)-2-pyridinyl]piperazin-2-one

4-[6-(ethylamino)-2-pyridinyl]piperazin-2-one (PubChem CID 80763941) has the molecular formula C11H16N4O and a molecular weight of 220.28 g/mol. Its IUPAC name is 4-[6-(ethylamino)-2-pyridinyl]piperazin-2-one.

Molecular Properties

Compound Name4-[6-(ethylamino)-2-pyridinyl]piperazin-2-one
PubChem CID80763941
Molecular FormulaC11H16N4O
Molecular Weight220.28 g/mol
Exact Mass220.13
IUPAC Name4-[6-(ethylamino)-2-pyridinyl]piperazin-2-one
SMILESCCNc1cccc(N2CCNC(=O)C2)n1
InChIInChI=1S/C11H16N4O/c1-2-12-9-4-3-5-10(14-9)15-7-6-13-11(16)8-15/h3-5H,2,6-8H2,1H3,(H,12,14)(H,13,16)
InChIKeyIPSAYOCGCSSTFN-UHFFFAOYSA-N
XLogP0.45
TPSA57.26 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.28
LogP ≤ 50.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-[6-(ethylamino)-2-pyridinyl]piperazin-2-one?
The IUPAC name of 4-[6-(ethylamino)-2-pyridinyl]piperazin-2-one (CID 80763941) is 4-[6-(ethylamino)-2-pyridinyl]piperazin-2-one.
What is the SMILES notation for 4-[6-(ethylamino)-2-pyridinyl]piperazin-2-one?
The canonical SMILES for 4-[6-(ethylamino)-2-pyridinyl]piperazin-2-one is CCNc1cccc(N2CCNC(=O)C2)n1.
What is the InChIKey of 4-[6-(ethylamino)-2-pyridinyl]piperazin-2-one?
The InChIKey is IPSAYOCGCSSTFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N4O/c1-2-12-9-4-3-5-10(14-9)15-7-6-13-11(16)8-15/h3-5H,2,6-8H2,1H3,(H,12,14)(H,13,16).
What are the key properties of 4-[6-(ethylamino)-2-pyridinyl]piperazin-2-one?
4-[6-(ethylamino)-2-pyridinyl]piperazin-2-one has a molecular weight of 220.28 g/mol, XLogP of 0.45, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[6-(ethylamino)-2-pyridinyl]piperazin-2-one is sourced from PubChem (CID 80763941), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).