3-(3-methoxy-3-methylpiperidin-1-yl)quinoxalin-2-amine

C15H20N4O — CID 107396287

IUPAC3-(3-methoxy-3-methylpiperidin-1-yl)quinoxalin-2-amine
SMILESCOC1(C)CCCN(c2nc3ccccc3nc2N)C1
InChIInChI=1S/C15H20N4O/c1-15(20-2)8-5-9-19(10-15)14-13(16)17-11-6-3-4-7-12(11)18-14/h3-4,6-7H,5,8-10H2,1-2H3,(H2,16,17)
InChIKeyRSQWCUBDASCVAR-UHFFFAOYSA-N
MW272.35 g/mol
LogP2.22
Rot. Bonds2

About 3-(3-methoxy-3-methylpiperidin-1-yl)quinoxalin-2-amine

3-(3-methoxy-3-methylpiperidin-1-yl)quinoxalin-2-amine (PubChem CID 107396287) has the molecular formula C15H20N4O and a molecular weight of 272.35 g/mol. Its IUPAC name is 3-(3-methoxy-3-methylpiperidin-1-yl)quinoxalin-2-amine.

Molecular Properties

Compound Name3-(3-methoxy-3-methylpiperidin-1-yl)quinoxalin-2-amine
PubChem CID107396287
Molecular FormulaC15H20N4O
Molecular Weight272.35 g/mol
Exact Mass272.16
IUPAC Name3-(3-methoxy-3-methylpiperidin-1-yl)quinoxalin-2-amine
SMILESCOC1(C)CCCN(c2nc3ccccc3nc2N)C1
InChIInChI=1S/C15H20N4O/c1-15(20-2)8-5-9-19(10-15)14-13(16)17-11-6-3-4-7-12(11)18-14/h3-4,6-7H,5,8-10H2,1-2H3,(H2,16,17)
InChIKeyRSQWCUBDASCVAR-UHFFFAOYSA-N
XLogP2.22
TPSA64.27 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-[(3-methoxy-3-methylpiperidin-1-yl)methyl]quinolin-2-amine
CID 107394991
2-[2-(3-methoxy-3-methylpiperidin-1-yl)imidazo[1,2-a]pyridin-3-yl]ethanamine
CID 107395888
3-(3,4-dimethoxypyrrolidin-1-yl)quinoxalin-2-amine
CID 103541708
5-chloro-2-(3-methoxy-3-methylpiperidin-1-yl)pyridin-3-amine
CID 107390515
3-(chloromethyl)-2-(3-methoxy-3-methylpiperidin-1-yl)pyridine
CID 107394384
[5-fluoro-4-(3-methoxy-3-methylpiperidin-1-yl)pyrimidin-2-yl]hydrazine
CID 107396489
4-(3-methoxy-3-methylpiperidin-1-yl)quinoline-3-carbonitrile
CID 107392588
4-(3-methoxy-3-methylpiperidin-1-yl)-6-propan-2-yloxypyrimidin-5-amine
CID 107390598
N'-hydroxy-3-(3-methoxy-3-methylpiperidin-1-yl)pyridazine-4-carboximidamide
CID 136716196
3-[(3S)-3-aminopiperidin-1-yl]quinoxalin-2-amine
CID 97165327
3,5-dibromo-2-(3-methoxy-3-methylpiperidin-1-yl)pyridine
CID 107394464
3-chloro-4-(3-methoxy-3-methylpiperidin-1-yl)aniline
CID 107390476

Frequently Asked Questions

What is the IUPAC name of 3-(3-methoxy-3-methylpiperidin-1-yl)quinoxalin-2-amine?
The IUPAC name of 3-(3-methoxy-3-methylpiperidin-1-yl)quinoxalin-2-amine (CID 107396287) is 3-(3-methoxy-3-methylpiperidin-1-yl)quinoxalin-2-amine.
What is the SMILES notation for 3-(3-methoxy-3-methylpiperidin-1-yl)quinoxalin-2-amine?
The canonical SMILES for 3-(3-methoxy-3-methylpiperidin-1-yl)quinoxalin-2-amine is COC1(C)CCCN(c2nc3ccccc3nc2N)C1.
What is the InChIKey of 3-(3-methoxy-3-methylpiperidin-1-yl)quinoxalin-2-amine?
The InChIKey is RSQWCUBDASCVAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O/c1-15(20-2)8-5-9-19(10-15)14-13(16)17-11-6-3-4-7-12(11)18-14/h3-4,6-7H,5,8-10H2,1-2H3,(H2,16,17).
What are the key properties of 3-(3-methoxy-3-methylpiperidin-1-yl)quinoxalin-2-amine?
3-(3-methoxy-3-methylpiperidin-1-yl)quinoxalin-2-amine has a molecular weight of 272.35 g/mol, XLogP of 2.22, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-methoxy-3-methylpiperidin-1-yl)quinoxalin-2-amine is sourced from PubChem (CID 107396287), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).