2-phenyl-1-quinoxalin-2-ylethanamine

C16H15N3 — CID 107356898

IUPAC2-phenyl-1-quinoxalin-2-ylethanamine
SMILESNC(Cc1ccccc1)c1cnc2ccccc2n1
InChIInChI=1S/C16H15N3/c17-13(10-12-6-2-1-3-7-12)16-11-18-14-8-4-5-9-15(14)19-16/h1-9,11,13H,10,17H2
InChIKeyLRWKEOWPUCEIEI-UHFFFAOYSA-N
MW249.32 g/mol
LogP2.87
Rot. Bonds3

About 2-phenyl-1-quinoxalin-2-ylethanamine

2-phenyl-1-quinoxalin-2-ylethanamine (PubChem CID 107356898) has the molecular formula C16H15N3 and a molecular weight of 249.32 g/mol. Its IUPAC name is 2-phenyl-1-quinoxalin-2-ylethanamine.

Molecular Properties

Compound Name2-phenyl-1-quinoxalin-2-ylethanamine
PubChem CID107356898
Molecular FormulaC16H15N3
Molecular Weight249.32 g/mol
Exact Mass249.13
IUPAC Name2-phenyl-1-quinoxalin-2-ylethanamine
SMILESNC(Cc1ccccc1)c1cnc2ccccc2n1
InChIInChI=1S/C16H15N3/c17-13(10-12-6-2-1-3-7-12)16-11-18-14-8-4-5-9-15(14)19-16/h1-9,11,13H,10,17H2
InChIKeyLRWKEOWPUCEIEI-UHFFFAOYSA-N
XLogP2.87
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.32
LogP ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-bromophenyl)-1-quinoxalin-2-ylethanamine
CID 107356915
1-quinoxalin-2-yl-2-thiophen-3-ylethanamine
CID 107357052
2-(3-bromo-5-fluorophenyl)-1-quinoxalin-2-ylethanamine
CID 107357326
N-methyl-2-phenyl-1-quinoxalin-2-ylethanamine
CID 107356897
1-quinoxalin-2-ylhexan-1-amine
CID 107357026
2-(2-bromo-5-fluorophenyl)-1-quinoxalin-2-ylethanamine
CID 107357047
2-(1-ethylimidazol-2-yl)-1-quinoxalin-2-ylethanamine
CID 107357294
(1S)-1-(6-methoxyquinolin-2-yl)-2-phenylethanamine
CID 146479702
2-(3-fluorophenyl)-1-quinoxalin-2-ylethanol
CID 107357548
2-(4-chlorophenyl)-1-quinolin-3-ylethanamine
CID 60924752
4-[2-(1-amino-2-phenylethyl)-4-pyridinyl]pyridin-2-amine
CID 69195162
benzyl N-[(1S)-1-quinoxalin-2-ylethyl]carbamate
CID 10804659

Frequently Asked Questions

What is the IUPAC name of 2-phenyl-1-quinoxalin-2-ylethanamine?
The IUPAC name of 2-phenyl-1-quinoxalin-2-ylethanamine (CID 107356898) is 2-phenyl-1-quinoxalin-2-ylethanamine.
What is the SMILES notation for 2-phenyl-1-quinoxalin-2-ylethanamine?
The canonical SMILES for 2-phenyl-1-quinoxalin-2-ylethanamine is NC(Cc1ccccc1)c1cnc2ccccc2n1.
What is the InChIKey of 2-phenyl-1-quinoxalin-2-ylethanamine?
The InChIKey is LRWKEOWPUCEIEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N3/c17-13(10-12-6-2-1-3-7-12)16-11-18-14-8-4-5-9-15(14)19-16/h1-9,11,13H,10,17H2.
What are the key properties of 2-phenyl-1-quinoxalin-2-ylethanamine?
2-phenyl-1-quinoxalin-2-ylethanamine has a molecular weight of 249.32 g/mol, XLogP of 2.87, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-1-quinoxalin-2-ylethanamine is sourced from PubChem (CID 107356898), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).