N-(2,6-dimethylpiperidin-1-yl)-3-methylquinoxalin-2-amine

C16H22N4 — CID 83026622

IUPACN-(2,6-dimethylpiperidin-1-yl)-3-methylquinoxalin-2-amine
SMILESCc1nc2ccccc2nc1NN1C(C)CCCC1C
InChIInChI=1S/C16H22N4/c1-11-7-6-8-12(2)20(11)19-16-13(3)17-14-9-4-5-10-15(14)18-16/h4-5,9-12H,6-8H2,1-3H3,(H,18,19)
InChIKeyXHAKHBDWINPCNI-UHFFFAOYSA-N
MW270.38 g/mol
LogP3.53
Rot. Bonds2

About N-(2,6-dimethylpiperidin-1-yl)-3-methylquinoxalin-2-amine

N-(2,6-dimethylpiperidin-1-yl)-3-methylquinoxalin-2-amine (PubChem CID 83026622) has the molecular formula C16H22N4 and a molecular weight of 270.38 g/mol. Its IUPAC name is N-(2,6-dimethylpiperidin-1-yl)-3-methylquinoxalin-2-amine.

Molecular Properties

Compound NameN-(2,6-dimethylpiperidin-1-yl)-3-methylquinoxalin-2-amine
PubChem CID83026622
Molecular FormulaC16H22N4
Molecular Weight270.38 g/mol
Exact Mass270.18
IUPAC NameN-(2,6-dimethylpiperidin-1-yl)-3-methylquinoxalin-2-amine
SMILESCc1nc2ccccc2nc1NN1C(C)CCCC1C
InChIInChI=1S/C16H22N4/c1-11-7-6-8-12(2)20(11)19-16-13(3)17-14-9-4-5-10-15(14)18-16/h4-5,9-12H,6-8H2,1-3H3,(H,18,19)
InChIKeyXHAKHBDWINPCNI-UHFFFAOYSA-N
XLogP3.53
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.38
LogP ≤ 53.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(2,6-dimethylpiperidin-1-yl)-3-methylquinoxalin-2-amine?
The IUPAC name of N-(2,6-dimethylpiperidin-1-yl)-3-methylquinoxalin-2-amine (CID 83026622) is N-(2,6-dimethylpiperidin-1-yl)-3-methylquinoxalin-2-amine.
What is the SMILES notation for N-(2,6-dimethylpiperidin-1-yl)-3-methylquinoxalin-2-amine?
The canonical SMILES for N-(2,6-dimethylpiperidin-1-yl)-3-methylquinoxalin-2-amine is Cc1nc2ccccc2nc1NN1C(C)CCCC1C.
What is the InChIKey of N-(2,6-dimethylpiperidin-1-yl)-3-methylquinoxalin-2-amine?
The InChIKey is XHAKHBDWINPCNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N4/c1-11-7-6-8-12(2)20(11)19-16-13(3)17-14-9-4-5-10-15(14)18-16/h4-5,9-12H,6-8H2,1-3H3,(H,18,19).
What are the key properties of N-(2,6-dimethylpiperidin-1-yl)-3-methylquinoxalin-2-amine?
N-(2,6-dimethylpiperidin-1-yl)-3-methylquinoxalin-2-amine has a molecular weight of 270.38 g/mol, XLogP of 3.53, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-dimethylpiperidin-1-yl)-3-methylquinoxalin-2-amine is sourced from PubChem (CID 83026622), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).