2,3-dimethyl-6-(piperidin-4-ylmethoxy)quinoxaline

C16H21N3O — CID 82189775

IUPAC2,3-dimethyl-6-(piperidin-4-ylmethoxy)quinoxaline
SMILESCc1nc2ccc(OCC3CCNCC3)cc2nc1C
InChIInChI=1S/C16H21N3O/c1-11-12(2)19-16-9-14(3-4-15(16)18-11)20-10-13-5-7-17-8-6-13/h3-4,9,13,17H,5-8,10H2,1-2H3
InChIKeyDNOLAMFMIHXYKY-UHFFFAOYSA-N
MW271.36 g/mol
LogP2.63
Rot. Bonds3

About 2,3-dimethyl-6-(piperidin-4-ylmethoxy)quinoxaline

2,3-dimethyl-6-(piperidin-4-ylmethoxy)quinoxaline (PubChem CID 82189775) has the molecular formula C16H21N3O and a molecular weight of 271.36 g/mol. Its IUPAC name is 2,3-dimethyl-6-(piperidin-4-ylmethoxy)quinoxaline.

Molecular Properties

Compound Name2,3-dimethyl-6-(piperidin-4-ylmethoxy)quinoxaline
PubChem CID82189775
Molecular FormulaC16H21N3O
Molecular Weight271.36 g/mol
Exact Mass271.17
IUPAC Name2,3-dimethyl-6-(piperidin-4-ylmethoxy)quinoxaline
SMILESCc1nc2ccc(OCC3CCNCC3)cc2nc1C
InChIInChI=1S/C16H21N3O/c1-11-12(2)19-16-9-14(3-4-15(16)18-11)20-10-13-5-7-17-8-6-13/h3-4,9,13,17H,5-8,10H2,1-2H3
InChIKeyDNOLAMFMIHXYKY-UHFFFAOYSA-N
XLogP2.63
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.36
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-(piperidin-4-ylmethoxy)-1,3-benzoxazole
CID 84695642
4-[(3,4-dimethylphenoxy)methyl]piperidine;hydrochloride
CID 56831093
4-[(4-methoxyphenoxy)methyl]piperidine;hydrochloride
CID 23724366
3-methyl-6-nitro-2-(piperidin-4-ylmethoxy)quinoxaline
CID 170582101
4-[(4-tert-butylphenoxy)methyl]piperidine;hydrochloride
CID 46735634
4-[(3,4-difluorophenoxy)methyl]piperidine
CID 17178047
2-[6-(piperidin-4-ylmethoxy)naphthalen-2-yl]ethanol
CID 170887467
2-methyl-4-(piperidin-4-ylmethoxy)benzamide
CID 81276896
(3S)-3-[(3,4-dimethylphenoxy)methyl]pyrrolidine
CID 86321220
5-(6-ethoxynaphthalen-2-yl)-2-(piperidin-4-ylmethoxy)pyrimidine
CID 86583153
4-(piperidin-4-ylmethoxy)benzonitrile
CID 10560682
3-(piperidin-4-ylmethoxy)aniline
CID 89233329

Frequently Asked Questions

What is the IUPAC name of 2,3-dimethyl-6-(piperidin-4-ylmethoxy)quinoxaline?
The IUPAC name of 2,3-dimethyl-6-(piperidin-4-ylmethoxy)quinoxaline (CID 82189775) is 2,3-dimethyl-6-(piperidin-4-ylmethoxy)quinoxaline.
What is the SMILES notation for 2,3-dimethyl-6-(piperidin-4-ylmethoxy)quinoxaline?
The canonical SMILES for 2,3-dimethyl-6-(piperidin-4-ylmethoxy)quinoxaline is Cc1nc2ccc(OCC3CCNCC3)cc2nc1C.
What is the InChIKey of 2,3-dimethyl-6-(piperidin-4-ylmethoxy)quinoxaline?
The InChIKey is DNOLAMFMIHXYKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N3O/c1-11-12(2)19-16-9-14(3-4-15(16)18-11)20-10-13-5-7-17-8-6-13/h3-4,9,13,17H,5-8,10H2,1-2H3.
What are the key properties of 2,3-dimethyl-6-(piperidin-4-ylmethoxy)quinoxaline?
2,3-dimethyl-6-(piperidin-4-ylmethoxy)quinoxaline has a molecular weight of 271.36 g/mol, XLogP of 2.63, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dimethyl-6-(piperidin-4-ylmethoxy)quinoxaline is sourced from PubChem (CID 82189775), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).