2-(4-quinoxalin-2-yloxyphenyl)ethanamine

C16H15N3O — CID 62360984

IUPAC2-(4-quinoxalin-2-yloxyphenyl)ethanamine
SMILESNCCc1ccc(Oc2cnc3ccccc3n2)cc1
InChIInChI=1S/C16H15N3O/c17-10-9-12-5-7-13(8-6-12)20-16-11-18-14-3-1-2-4-15(14)19-16/h1-8,11H,9-10,17H2
InChIKeyAGAZQQAFYDEOKI-UHFFFAOYSA-N
MW265.32 g/mol
LogP2.92
Rot. Bonds4

About 2-(4-quinoxalin-2-yloxyphenyl)ethanamine

2-(4-quinoxalin-2-yloxyphenyl)ethanamine (PubChem CID 62360984) has the molecular formula C16H15N3O and a molecular weight of 265.32 g/mol. Its IUPAC name is 2-(4-quinoxalin-2-yloxyphenyl)ethanamine.

Molecular Properties

Compound Name2-(4-quinoxalin-2-yloxyphenyl)ethanamine
PubChem CID62360984
Molecular FormulaC16H15N3O
Molecular Weight265.32 g/mol
Exact Mass265.12
IUPAC Name2-(4-quinoxalin-2-yloxyphenyl)ethanamine
SMILESNCCc1ccc(Oc2cnc3ccccc3n2)cc1
InChIInChI=1S/C16H15N3O/c17-10-9-12-5-7-13(8-6-12)20-16-11-18-14-3-1-2-4-15(14)19-16/h1-8,11H,9-10,17H2
InChIKeyAGAZQQAFYDEOKI-UHFFFAOYSA-N
XLogP2.92
TPSA61.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.32
LogP ≤ 52.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(4-quinoxalin-2-yloxyphenyl)ethanamine?
The IUPAC name of 2-(4-quinoxalin-2-yloxyphenyl)ethanamine (CID 62360984) is 2-(4-quinoxalin-2-yloxyphenyl)ethanamine.
What is the SMILES notation for 2-(4-quinoxalin-2-yloxyphenyl)ethanamine?
The canonical SMILES for 2-(4-quinoxalin-2-yloxyphenyl)ethanamine is NCCc1ccc(Oc2cnc3ccccc3n2)cc1.
What is the InChIKey of 2-(4-quinoxalin-2-yloxyphenyl)ethanamine?
The InChIKey is AGAZQQAFYDEOKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N3O/c17-10-9-12-5-7-13(8-6-12)20-16-11-18-14-3-1-2-4-15(14)19-16/h1-8,11H,9-10,17H2.
What are the key properties of 2-(4-quinoxalin-2-yloxyphenyl)ethanamine?
2-(4-quinoxalin-2-yloxyphenyl)ethanamine has a molecular weight of 265.32 g/mol, XLogP of 2.92, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-quinoxalin-2-yloxyphenyl)ethanamine is sourced from PubChem (CID 62360984), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).