6-piperidin-3-yl-1H-quinoxalin-2-one

C13H15N3O — CID 117330760

IUPAC6-piperidin-3-yl-1H-quinoxalin-2-one
SMILESO=c1cnc2cc(C3CCCNC3)ccc2[nH]1
InChIInChI=1S/C13H15N3O/c17-13-8-15-12-6-9(3-4-11(12)16-13)10-2-1-5-14-7-10/h3-4,6,8,10,14H,1-2,5,7H2,(H,16,17)
InChIKeyFNFSVAVNLOHLEX-UHFFFAOYSA-N
MW229.28 g/mol
LogP1.39
Rot. Bonds1

About 6-piperidin-3-yl-1H-quinoxalin-2-one

6-piperidin-3-yl-1H-quinoxalin-2-one (PubChem CID 117330760) has the molecular formula C13H15N3O and a molecular weight of 229.28 g/mol. Its IUPAC name is 6-piperidin-3-yl-1H-quinoxalin-2-one.

Molecular Properties

Compound Name6-piperidin-3-yl-1H-quinoxalin-2-one
PubChem CID117330760
Molecular FormulaC13H15N3O
Molecular Weight229.28 g/mol
Exact Mass229.12
IUPAC Name6-piperidin-3-yl-1H-quinoxalin-2-one
SMILESO=c1cnc2cc(C3CCCNC3)ccc2[nH]1
InChIInChI=1S/C13H15N3O/c17-13-8-15-12-6-9(3-4-11(12)16-13)10-2-1-5-14-7-10/h3-4,6,8,10,14H,1-2,5,7H2,(H,16,17)
InChIKeyFNFSVAVNLOHLEX-UHFFFAOYSA-N
XLogP1.39
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.28
LogP ≤ 51.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-piperidin-3-yl-1H-quinoxalin-2-one?
The IUPAC name of 6-piperidin-3-yl-1H-quinoxalin-2-one (CID 117330760) is 6-piperidin-3-yl-1H-quinoxalin-2-one.
What is the SMILES notation for 6-piperidin-3-yl-1H-quinoxalin-2-one?
The canonical SMILES for 6-piperidin-3-yl-1H-quinoxalin-2-one is O=c1cnc2cc(C3CCCNC3)ccc2[nH]1.
What is the InChIKey of 6-piperidin-3-yl-1H-quinoxalin-2-one?
The InChIKey is FNFSVAVNLOHLEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3O/c17-13-8-15-12-6-9(3-4-11(12)16-13)10-2-1-5-14-7-10/h3-4,6,8,10,14H,1-2,5,7H2,(H,16,17).
What are the key properties of 6-piperidin-3-yl-1H-quinoxalin-2-one?
6-piperidin-3-yl-1H-quinoxalin-2-one has a molecular weight of 229.28 g/mol, XLogP of 1.39, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-piperidin-3-yl-1H-quinoxalin-2-one is sourced from PubChem (CID 117330760), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).