2-ethoxy-3-(piperidin-3-ylmethoxy)quinoxaline

C16H21N3O2 — CID 71639733

IUPAC2-ethoxy-3-(piperidin-3-ylmethoxy)quinoxaline
SMILESCCOc1nc2ccccc2nc1OCC1CCCNC1
InChIInChI=1S/C16H21N3O2/c1-2-20-15-16(21-11-12-6-5-9-17-10-12)19-14-8-4-3-7-13(14)18-15/h3-4,7-8,12,17H,2,5-6,9-11H2,1H3
InChIKeyWBMQSVFCESJWEM-UHFFFAOYSA-N
MW287.36 g/mol
LogP2.41
Rot. Bonds5

About 2-ethoxy-3-(piperidin-3-ylmethoxy)quinoxaline

2-ethoxy-3-(piperidin-3-ylmethoxy)quinoxaline (PubChem CID 71639733) has the molecular formula C16H21N3O2 and a molecular weight of 287.36 g/mol. Its IUPAC name is 2-ethoxy-3-(piperidin-3-ylmethoxy)quinoxaline.

Molecular Properties

Compound Name2-ethoxy-3-(piperidin-3-ylmethoxy)quinoxaline
PubChem CID71639733
Molecular FormulaC16H21N3O2
Molecular Weight287.36 g/mol
Exact Mass287.16
IUPAC Name2-ethoxy-3-(piperidin-3-ylmethoxy)quinoxaline
SMILESCCOc1nc2ccccc2nc1OCC1CCCNC1
InChIInChI=1S/C16H21N3O2/c1-2-20-15-16(21-11-12-6-5-9-17-10-12)19-14-8-4-3-7-13(14)18-15/h3-4,7-8,12,17H,2,5-6,9-11H2,1H3
InChIKeyWBMQSVFCESJWEM-UHFFFAOYSA-N
XLogP2.41
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 ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-methyl-3-(piperidin-3-ylmethoxy)quinoxaline
CID 55067629
3-[[(3S)-piperidin-3-yl]methoxy]quinoxalin-2-amine
CID 97165192
2-methoxy-3-[[(3S)-pyrrolidin-3-yl]methoxy]quinoxaline
CID 97164916
2-methoxy-3-(pyrrolidin-3-ylmethoxy)quinoxaline
CID 71643111
3-ethoxy-N-methyl-N-[(3S)-piperidin-3-yl]quinoxalin-2-amine
CID 71639633
3-(piperidin-3-ylmethoxy)-1,2,4-benzotriazine
CID 103204980
2-methoxy-3-[3-[(3S)-piperidin-3-yl]propoxy]quinoxaline
CID 97164923
3-ethoxy-N-methyl-N-[(3R)-pyrrolidin-3-yl]quinoxalin-2-amine
CID 71639631
3-methyl-2-(pyrrolidin-3-ylmethoxy)quinoline
CID 63228996
3-ethoxy-N-methyl-N-[(3S)-pyrrolidin-3-yl]quinoxalin-2-amine
CID 71639635
2-[[(3R)-piperidin-3-yl]methoxy]-1,3-benzoxazole
CID 94407294
(3S)-3-(phenoxymethyl)piperidine
CID 26190643

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-3-(piperidin-3-ylmethoxy)quinoxaline?
The IUPAC name of 2-ethoxy-3-(piperidin-3-ylmethoxy)quinoxaline (CID 71639733) is 2-ethoxy-3-(piperidin-3-ylmethoxy)quinoxaline.
What is the SMILES notation for 2-ethoxy-3-(piperidin-3-ylmethoxy)quinoxaline?
The canonical SMILES for 2-ethoxy-3-(piperidin-3-ylmethoxy)quinoxaline is CCOc1nc2ccccc2nc1OCC1CCCNC1.
What is the InChIKey of 2-ethoxy-3-(piperidin-3-ylmethoxy)quinoxaline?
The InChIKey is WBMQSVFCESJWEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N3O2/c1-2-20-15-16(21-11-12-6-5-9-17-10-12)19-14-8-4-3-7-13(14)18-15/h3-4,7-8,12,17H,2,5-6,9-11H2,1H3.
What are the key properties of 2-ethoxy-3-(piperidin-3-ylmethoxy)quinoxaline?
2-ethoxy-3-(piperidin-3-ylmethoxy)quinoxaline has a molecular weight of 287.36 g/mol, XLogP of 2.41, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-3-(piperidin-3-ylmethoxy)quinoxaline is sourced from PubChem (CID 71639733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).