1-(3-methoxyquinoxalin-2-yl)-N-methylpiperidin-4-amine;hydrochloride

C15H21ClN4O — CID 71642824

IUPAC1-(3-methoxyquinoxalin-2-yl)-N-methylpiperidin-4-amine;hydrochloride
SMILESCNC1CCN(c2nc3ccccc3nc2OC)CC1.Cl
InChIInChI=1S/C15H20N4O.ClH/c1-16-11-7-9-19(10-8-11)14-15(20-2)18-13-6-4-3-5-12(13)17-14;/h3-6,11,16H,7-10H2,1-2H3;1H
InChIKeyMQCAJWULWMYEQU-UHFFFAOYSA-N
MW308.81 g/mol
LogP2.25
Rot. Bonds3

About 1-(3-methoxyquinoxalin-2-yl)-N-methylpiperidin-4-amine;hydrochloride

1-(3-methoxyquinoxalin-2-yl)-N-methylpiperidin-4-amine;hydrochloride (PubChem CID 71642824) has the molecular formula C15H21ClN4O and a molecular weight of 308.81 g/mol. Its IUPAC name is 1-(3-methoxyquinoxalin-2-yl)-N-methylpiperidin-4-amine;hydrochloride.

Molecular Properties

Compound Name1-(3-methoxyquinoxalin-2-yl)-N-methylpiperidin-4-amine;hydrochloride
PubChem CID71642824
Molecular FormulaC15H21ClN4O
Molecular Weight308.81 g/mol
Exact Mass308.14
IUPAC Name1-(3-methoxyquinoxalin-2-yl)-N-methylpiperidin-4-amine;hydrochloride
SMILESCNC1CCN(c2nc3ccccc3nc2OC)CC1.Cl
InChIInChI=1S/C15H20N4O.ClH/c1-16-11-7-9-19(10-8-11)14-15(20-2)18-13-6-4-3-5-12(13)17-14;/h3-6,11,16H,7-10H2,1-2H3;1H
InChIKeyMQCAJWULWMYEQU-UHFFFAOYSA-N
XLogP2.25
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.81
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-(3-methoxyquinoxalin-2-yl)-N-methylpiperidin-4-amine;hydrochloride?
The IUPAC name of 1-(3-methoxyquinoxalin-2-yl)-N-methylpiperidin-4-amine;hydrochloride (CID 71642824) is 1-(3-methoxyquinoxalin-2-yl)-N-methylpiperidin-4-amine;hydrochloride.
What is the SMILES notation for 1-(3-methoxyquinoxalin-2-yl)-N-methylpiperidin-4-amine;hydrochloride?
The canonical SMILES for 1-(3-methoxyquinoxalin-2-yl)-N-methylpiperidin-4-amine;hydrochloride is CNC1CCN(c2nc3ccccc3nc2OC)CC1.Cl.
What is the InChIKey of 1-(3-methoxyquinoxalin-2-yl)-N-methylpiperidin-4-amine;hydrochloride?
The InChIKey is MQCAJWULWMYEQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O.ClH/c1-16-11-7-9-19(10-8-11)14-15(20-2)18-13-6-4-3-5-12(13)17-14;/h3-6,11,16H,7-10H2,1-2H3;1H.
What are the key properties of 1-(3-methoxyquinoxalin-2-yl)-N-methylpiperidin-4-amine;hydrochloride?
1-(3-methoxyquinoxalin-2-yl)-N-methylpiperidin-4-amine;hydrochloride has a molecular weight of 308.81 g/mol, XLogP of 2.25, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-methoxyquinoxalin-2-yl)-N-methylpiperidin-4-amine;hydrochloride is sourced from PubChem (CID 71642824), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).