4-[(4-quinoxalin-2-yloxypiperidin-1-yl)methyl]-1H-pyridin-2-one

C19H20N4O2 — CID 166250918

IUPAC4-[(4-quinoxalin-2-yloxypiperidin-1-yl)methyl]-1H-pyridin-2-one
SMILESO=c1cc(CN2CCC(Oc3cnc4ccccc4n3)CC2)cc[nH]1
InChIInChI=1S/C19H20N4O2/c24-18-11-14(5-8-20-18)13-23-9-6-15(7-10-23)25-19-12-21-16-3-1-2-4-17(16)22-19/h1-5,8,11-12,15H,6-7,9-10,13H2,(H,20,24)
InChIKeyPSMXRFVUOMCOIX-UHFFFAOYSA-N
MW336.40 g/mol
LogP2.36
Rot. Bonds4

About 4-[(4-quinoxalin-2-yloxypiperidin-1-yl)methyl]-1H-pyridin-2-one

4-[(4-quinoxalin-2-yloxypiperidin-1-yl)methyl]-1H-pyridin-2-one (PubChem CID 166250918) has the molecular formula C19H20N4O2 and a molecular weight of 336.40 g/mol. Its IUPAC name is 4-[(4-quinoxalin-2-yloxypiperidin-1-yl)methyl]-1H-pyridin-2-one.

Molecular Properties

Compound Name4-[(4-quinoxalin-2-yloxypiperidin-1-yl)methyl]-1H-pyridin-2-one
PubChem CID166250918
Molecular FormulaC19H20N4O2
Molecular Weight336.40 g/mol
Exact Mass336.16
IUPAC Name4-[(4-quinoxalin-2-yloxypiperidin-1-yl)methyl]-1H-pyridin-2-one
SMILESO=c1cc(CN2CCC(Oc3cnc4ccccc4n3)CC2)cc[nH]1
InChIInChI=1S/C19H20N4O2/c24-18-11-14(5-8-20-18)13-23-9-6-15(7-10-23)25-19-12-21-16-3-1-2-4-17(16)22-19/h1-5,8,11-12,15H,6-7,9-10,13H2,(H,20,24)
InChIKeyPSMXRFVUOMCOIX-UHFFFAOYSA-N
XLogP2.36
TPSA71.11 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.40
LogP ≤ 52.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-[(4-quinoxalin-2-yloxypiperidin-1-yl)methyl]-1H-pyridin-2-one?
The IUPAC name of 4-[(4-quinoxalin-2-yloxypiperidin-1-yl)methyl]-1H-pyridin-2-one (CID 166250918) is 4-[(4-quinoxalin-2-yloxypiperidin-1-yl)methyl]-1H-pyridin-2-one.
What is the SMILES notation for 4-[(4-quinoxalin-2-yloxypiperidin-1-yl)methyl]-1H-pyridin-2-one?
The canonical SMILES for 4-[(4-quinoxalin-2-yloxypiperidin-1-yl)methyl]-1H-pyridin-2-one is O=c1cc(CN2CCC(Oc3cnc4ccccc4n3)CC2)cc[nH]1.
What is the InChIKey of 4-[(4-quinoxalin-2-yloxypiperidin-1-yl)methyl]-1H-pyridin-2-one?
The InChIKey is PSMXRFVUOMCOIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N4O2/c24-18-11-14(5-8-20-18)13-23-9-6-15(7-10-23)25-19-12-21-16-3-1-2-4-17(16)22-19/h1-5,8,11-12,15H,6-7,9-10,13H2,(H,20,24).
What are the key properties of 4-[(4-quinoxalin-2-yloxypiperidin-1-yl)methyl]-1H-pyridin-2-one?
4-[(4-quinoxalin-2-yloxypiperidin-1-yl)methyl]-1H-pyridin-2-one has a molecular weight of 336.40 g/mol, XLogP of 2.36, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(4-quinoxalin-2-yloxypiperidin-1-yl)methyl]-1H-pyridin-2-one is sourced from PubChem (CID 166250918), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).