N-methyl-1-[2-(4-methyl-2,3-dihydroquinoxalin-1-yl)phenyl]ethanamine

C18H23N3 — CID 63778753

IUPACN-methyl-1-[2-(4-methyl-2,3-dihydroquinoxalin-1-yl)phenyl]ethanamine
SMILESCNC(C)c1ccccc1N1CCN(C)c2ccccc21
InChIInChI=1S/C18H23N3/c1-14(19-2)15-8-4-5-9-16(15)21-13-12-20(3)17-10-6-7-11-18(17)21/h4-11,14,19H,12-13H2,1-3H3
InChIKeySNURUCBDCFUFJT-UHFFFAOYSA-N
MW281.40 g/mol
LogP3.55
Rot. Bonds3

About N-methyl-1-[2-(4-methyl-2,3-dihydroquinoxalin-1-yl)phenyl]ethanamine

N-methyl-1-[2-(4-methyl-2,3-dihydroquinoxalin-1-yl)phenyl]ethanamine (PubChem CID 63778753) has the molecular formula C18H23N3 and a molecular weight of 281.40 g/mol. Its IUPAC name is N-methyl-1-[2-(4-methyl-2,3-dihydroquinoxalin-1-yl)phenyl]ethanamine.

Molecular Properties

Compound NameN-methyl-1-[2-(4-methyl-2,3-dihydroquinoxalin-1-yl)phenyl]ethanamine
PubChem CID63778753
Molecular FormulaC18H23N3
Molecular Weight281.40 g/mol
Exact Mass281.19
IUPAC NameN-methyl-1-[2-(4-methyl-2,3-dihydroquinoxalin-1-yl)phenyl]ethanamine
SMILESCNC(C)c1ccccc1N1CCN(C)c2ccccc21
InChIInChI=1S/C18H23N3/c1-14(19-2)15-8-4-5-9-16(15)21-13-12-20(3)17-10-6-7-11-18(17)21/h4-11,14,19H,12-13H2,1-3H3
InChIKeySNURUCBDCFUFJT-UHFFFAOYSA-N
XLogP3.55
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.40
LogP ≤ 53.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-methyl-1-[2-(4-methyl-2,3-dihydroquinoxalin-1-yl)phenyl]ethanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-methyl-1-[4-(4-methyl-2,3-dihydroquinoxalin-1-yl)phenyl]ethanamine
CID 63776759
N-methyl-1-[2-(4-methyl-2,3-dihydroquinoxalin-1-yl)-1,3-thiazol-4-yl]ethanamine
CID 64543382
1-[2-[1-(methylamino)ethyl]phenyl]-1,3-diazinan-2-one
CID 65295411
(1R)-1-[5-fluoro-2-(4-methyl-2,3-dihydroquinoxalin-1-yl)phenyl]ethanamine
CID 63778940
1-[2-(bromomethyl)phenyl]-4-methyl-2,3-dihydroquinoxaline
CID 107083737
2-[2-[1-(methylamino)ethyl]phenyl]-3,4-dihydroisoquinolin-1-one
CID 83091171
N-methyl-1-[2-(2-methylazetidin-1-yl)phenyl]ethanamine
CID 79678667
1-[2-(4,4-dimethylpiperidin-1-yl)phenyl]-N-methylethanamine
CID 62936574
N-methyl-1-[2-(2-methylpyrrolidin-1-yl)phenyl]ethanamine
CID 60974257
1-[1-[2-[1-(methylamino)ethyl]phenyl]piperidin-4-yl]ethanol
CID 106836301
N-methyl-1-[2-(4-methylsulfonylpiperazin-1-yl)phenyl]ethanamine
CID 62994127
1-[2-(4,4-diethylpiperidin-1-yl)phenyl]-N-methylethanamine
CID 63158539

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-[2-(4-methyl-2,3-dihydroquinoxalin-1-yl)phenyl]ethanamine?
The IUPAC name of N-methyl-1-[2-(4-methyl-2,3-dihydroquinoxalin-1-yl)phenyl]ethanamine (CID 63778753) is N-methyl-1-[2-(4-methyl-2,3-dihydroquinoxalin-1-yl)phenyl]ethanamine.
What is the SMILES notation for N-methyl-1-[2-(4-methyl-2,3-dihydroquinoxalin-1-yl)phenyl]ethanamine?
The canonical SMILES for N-methyl-1-[2-(4-methyl-2,3-dihydroquinoxalin-1-yl)phenyl]ethanamine is CNC(C)c1ccccc1N1CCN(C)c2ccccc21.
What is the InChIKey of N-methyl-1-[2-(4-methyl-2,3-dihydroquinoxalin-1-yl)phenyl]ethanamine?
The InChIKey is SNURUCBDCFUFJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N3/c1-14(19-2)15-8-4-5-9-16(15)21-13-12-20(3)17-10-6-7-11-18(17)21/h4-11,14,19H,12-13H2,1-3H3.
What are the key properties of N-methyl-1-[2-(4-methyl-2,3-dihydroquinoxalin-1-yl)phenyl]ethanamine?
N-methyl-1-[2-(4-methyl-2,3-dihydroquinoxalin-1-yl)phenyl]ethanamine has a molecular weight of 281.40 g/mol, XLogP of 3.55, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-[2-(4-methyl-2,3-dihydroquinoxalin-1-yl)phenyl]ethanamine is sourced from PubChem (CID 63778753), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).