2-chloro-3-(piperidin-4-ylmethoxy)quinoxaline

C14H16ClN3O — CID 71640763

IUPAC2-chloro-3-(piperidin-4-ylmethoxy)quinoxaline
SMILESClc1nc2ccccc2nc1OCC1CCNCC1
InChIInChI=1S/C14H16ClN3O/c15-13-14(19-9-10-5-7-16-8-6-10)18-12-4-2-1-3-11(12)17-13/h1-4,10,16H,5-9H2
InChIKeyBOYNHEKTMBQQJH-UHFFFAOYSA-N
MW277.75 g/mol
LogP2.66
Rot. Bonds3

About 2-chloro-3-(piperidin-4-ylmethoxy)quinoxaline

2-chloro-3-(piperidin-4-ylmethoxy)quinoxaline (PubChem CID 71640763) has the molecular formula C14H16ClN3O and a molecular weight of 277.75 g/mol. Its IUPAC name is 2-chloro-3-(piperidin-4-ylmethoxy)quinoxaline.

Molecular Properties

Compound Name2-chloro-3-(piperidin-4-ylmethoxy)quinoxaline
PubChem CID71640763
Molecular FormulaC14H16ClN3O
Molecular Weight277.75 g/mol
Exact Mass277.10
IUPAC Name2-chloro-3-(piperidin-4-ylmethoxy)quinoxaline
SMILESClc1nc2ccccc2nc1OCC1CCNCC1
InChIInChI=1S/C14H16ClN3O/c15-13-14(19-9-10-5-7-16-8-6-10)18-12-4-2-1-3-11(12)17-13/h1-4,10,16H,5-9H2
InChIKeyBOYNHEKTMBQQJH-UHFFFAOYSA-N
XLogP2.66
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.75
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-(piperidin-4-ylmethoxy)quinoxalin-2-amine
CID 71644088
2-(methoxymethyl)-3-(piperidin-4-ylmethoxy)quinoxaline
CID 170395086
2-methoxy-3-(pyrrolidin-3-ylmethoxy)quinoxaline
CID 71643111
2-methoxy-3-[[(3S)-pyrrolidin-3-yl]methoxy]quinoxaline
CID 97164916
2-chloro-3-(piperidin-4-ylmethylsulfanyl)quinoxaline;hydrochloride
CID 71639828
3-chloro-2-(piperidin-4-ylmethoxy)pyridine;hydrochloride
CID 162422899
N-cyclopropyl-3-(pyrrolidin-3-ylmethoxy)quinoxalin-2-amine
CID 71636942
N-cyclopropyl-3-[[(3R)-pyrrolidin-3-yl]methoxy]quinoxalin-2-amine
CID 97178411
2-ethoxy-3-(piperidin-3-ylmethoxy)quinoxaline
CID 71639733
3-methyl-2-(pyrrolidin-3-ylmethoxy)quinoline
CID 63228996
2-chloro-3-[(R)-piperidin-4-ylmethylsulfinyl]quinoxaline
CID 97163529
2-(piperidin-4-ylmethoxy)pyridin-3-ol
CID 71646429

Frequently Asked Questions

What is the IUPAC name of 2-chloro-3-(piperidin-4-ylmethoxy)quinoxaline?
The IUPAC name of 2-chloro-3-(piperidin-4-ylmethoxy)quinoxaline (CID 71640763) is 2-chloro-3-(piperidin-4-ylmethoxy)quinoxaline.
What is the SMILES notation for 2-chloro-3-(piperidin-4-ylmethoxy)quinoxaline?
The canonical SMILES for 2-chloro-3-(piperidin-4-ylmethoxy)quinoxaline is Clc1nc2ccccc2nc1OCC1CCNCC1.
What is the InChIKey of 2-chloro-3-(piperidin-4-ylmethoxy)quinoxaline?
The InChIKey is BOYNHEKTMBQQJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16ClN3O/c15-13-14(19-9-10-5-7-16-8-6-10)18-12-4-2-1-3-11(12)17-13/h1-4,10,16H,5-9H2.
What are the key properties of 2-chloro-3-(piperidin-4-ylmethoxy)quinoxaline?
2-chloro-3-(piperidin-4-ylmethoxy)quinoxaline has a molecular weight of 277.75 g/mol, XLogP of 2.66, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-3-(piperidin-4-ylmethoxy)quinoxaline is sourced from PubChem (CID 71640763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).