2-methyl-3-[(6-piperidin-1-yl-2-pyridinyl)methoxy]quinoxaline

C20H22N4O — CID 72706533

IUPAC2-methyl-3-[(6-piperidin-1-yl-2-pyridinyl)methoxy]quinoxaline
SMILESCc1nc2ccccc2nc1OCc1cccc(N2CCCCC2)n1
InChIInChI=1S/C20H22N4O/c1-15-20(23-18-10-4-3-9-17(18)21-15)25-14-16-8-7-11-19(22-16)24-12-5-2-6-13-24/h3-4,7-11H,2,5-6,12-14H2,1H3
InChIKeyKGMXOILUFTUXEP-UHFFFAOYSA-N
MW334.42 g/mol
LogP3.90
Rot. Bonds4

About 2-methyl-3-[(6-piperidin-1-yl-2-pyridinyl)methoxy]quinoxaline

2-methyl-3-[(6-piperidin-1-yl-2-pyridinyl)methoxy]quinoxaline (PubChem CID 72706533) has the molecular formula C20H22N4O and a molecular weight of 334.42 g/mol. Its IUPAC name is 2-methyl-3-[(6-piperidin-1-yl-2-pyridinyl)methoxy]quinoxaline.

Molecular Properties

Compound Name2-methyl-3-[(6-piperidin-1-yl-2-pyridinyl)methoxy]quinoxaline
PubChem CID72706533
Molecular FormulaC20H22N4O
Molecular Weight334.42 g/mol
Exact Mass334.18
IUPAC Name2-methyl-3-[(6-piperidin-1-yl-2-pyridinyl)methoxy]quinoxaline
SMILESCc1nc2ccccc2nc1OCc1cccc(N2CCCCC2)n1
InChIInChI=1S/C20H22N4O/c1-15-20(23-18-10-4-3-9-17(18)21-15)25-14-16-8-7-11-19(22-16)24-12-5-2-6-13-24/h3-4,7-11H,2,5-6,12-14H2,1H3
InChIKeyKGMXOILUFTUXEP-UHFFFAOYSA-N
XLogP3.90
TPSA51.14 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.42
LogP ≤ 53.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-3-[(6-piperidin-1-yl-2-pyridinyl)methoxy]quinoxaline?
The IUPAC name of 2-methyl-3-[(6-piperidin-1-yl-2-pyridinyl)methoxy]quinoxaline (CID 72706533) is 2-methyl-3-[(6-piperidin-1-yl-2-pyridinyl)methoxy]quinoxaline.
What is the SMILES notation for 2-methyl-3-[(6-piperidin-1-yl-2-pyridinyl)methoxy]quinoxaline?
The canonical SMILES for 2-methyl-3-[(6-piperidin-1-yl-2-pyridinyl)methoxy]quinoxaline is Cc1nc2ccccc2nc1OCc1cccc(N2CCCCC2)n1.
What is the InChIKey of 2-methyl-3-[(6-piperidin-1-yl-2-pyridinyl)methoxy]quinoxaline?
The InChIKey is KGMXOILUFTUXEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N4O/c1-15-20(23-18-10-4-3-9-17(18)21-15)25-14-16-8-7-11-19(22-16)24-12-5-2-6-13-24/h3-4,7-11H,2,5-6,12-14H2,1H3.
What are the key properties of 2-methyl-3-[(6-piperidin-1-yl-2-pyridinyl)methoxy]quinoxaline?
2-methyl-3-[(6-piperidin-1-yl-2-pyridinyl)methoxy]quinoxaline has a molecular weight of 334.42 g/mol, XLogP of 3.90, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-3-[(6-piperidin-1-yl-2-pyridinyl)methoxy]quinoxaline is sourced from PubChem (CID 72706533), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).