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

C16H21N3O2 — CID 170395086

IUPAC2-(methoxymethyl)-3-(piperidin-4-ylmethoxy)quinoxaline
SMILESCOCc1nc2ccccc2nc1OCC1CCNCC1
InChIInChI=1S/C16H21N3O2/c1-20-11-15-16(21-10-12-6-8-17-9-7-12)19-14-5-3-2-4-13(14)18-15/h2-5,12,17H,6-11H2,1H3
InChIKeyVLVOIXKHHZXKMO-UHFFFAOYSA-N
MW287.36 g/mol
LogP2.15
Rot. Bonds5

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

2-(methoxymethyl)-3-(piperidin-4-ylmethoxy)quinoxaline (PubChem CID 170395086) has the molecular formula C16H21N3O2 and a molecular weight of 287.36 g/mol. Its IUPAC name is 2-(methoxymethyl)-3-(piperidin-4-ylmethoxy)quinoxaline.

Molecular Properties

Compound Name2-(methoxymethyl)-3-(piperidin-4-ylmethoxy)quinoxaline
PubChem CID170395086
Molecular FormulaC16H21N3O2
Molecular Weight287.36 g/mol
Exact Mass287.16
IUPAC Name2-(methoxymethyl)-3-(piperidin-4-ylmethoxy)quinoxaline
SMILESCOCc1nc2ccccc2nc1OCC1CCNCC1
InChIInChI=1S/C16H21N3O2/c1-20-11-15-16(21-10-12-6-8-17-9-7-12)19-14-5-3-2-4-13(14)18-15/h2-5,12,17H,6-11H2,1H3
InChIKeyVLVOIXKHHZXKMO-UHFFFAOYSA-N
XLogP2.15
TPSA56.27 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.36
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-(piperidin-4-ylmethoxy)quinoxalin-2-amine
CID 71644088
2-chloro-3-(piperidin-4-ylmethoxy)quinoxaline
CID 71640763
2-methoxy-3-(pyrrolidin-3-ylmethoxy)quinoxaline
CID 71643111
2-methoxy-3-[[(3S)-pyrrolidin-3-yl]methoxy]quinoxaline
CID 97164916
3-methyl-2-(pyrrolidin-3-ylmethoxy)quinoline
CID 63228996
N-cyclopropyl-3-(pyrrolidin-3-ylmethoxy)quinoxalin-2-amine
CID 71636942
N-cyclopropyl-3-[[(3R)-pyrrolidin-3-yl]methoxy]quinoxalin-2-amine
CID 97178411
4-[(2-methoxyphenoxy)methyl]piperidine
CID 22248030
2-methyl-3-(piperidin-3-ylmethoxy)quinoxaline
CID 55067629
2-ethoxy-3-(piperidin-3-ylmethoxy)quinoxaline
CID 71639733
4-[(4-methoxyphenoxy)methyl]piperidine;hydrochloride
CID 23724366
2-(piperidin-4-ylmethoxy)pyridin-3-ol
CID 71646429

Frequently Asked Questions

What is the IUPAC name of 2-(methoxymethyl)-3-(piperidin-4-ylmethoxy)quinoxaline?
The IUPAC name of 2-(methoxymethyl)-3-(piperidin-4-ylmethoxy)quinoxaline (CID 170395086) is 2-(methoxymethyl)-3-(piperidin-4-ylmethoxy)quinoxaline.
What is the SMILES notation for 2-(methoxymethyl)-3-(piperidin-4-ylmethoxy)quinoxaline?
The canonical SMILES for 2-(methoxymethyl)-3-(piperidin-4-ylmethoxy)quinoxaline is COCc1nc2ccccc2nc1OCC1CCNCC1.
What is the InChIKey of 2-(methoxymethyl)-3-(piperidin-4-ylmethoxy)quinoxaline?
The InChIKey is VLVOIXKHHZXKMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N3O2/c1-20-11-15-16(21-10-12-6-8-17-9-7-12)19-14-5-3-2-4-13(14)18-15/h2-5,12,17H,6-11H2,1H3.
What are the key properties of 2-(methoxymethyl)-3-(piperidin-4-ylmethoxy)quinoxaline?
2-(methoxymethyl)-3-(piperidin-4-ylmethoxy)quinoxaline has a molecular weight of 287.36 g/mol, XLogP of 2.15, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methoxymethyl)-3-(piperidin-4-ylmethoxy)quinoxaline is sourced from PubChem (CID 170395086), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).