2-(6-methoxy-3-pyridinyl)ethanamine

C8H12N2O — CID 53407550

IUPAC2-(6-methoxy-3-pyridinyl)ethanamine
SMILESCOc1ccc(CCN)cn1
InChIInChI=1S/C8H12N2O/c1-11-8-3-2-7(4-5-9)6-10-8/h2-3,6H,4-5,9H2,1H3
InChIKeyYNLWLBAHWMOFBQ-UHFFFAOYSA-N
MW152.20 g/mol
LogP0.59
Rot. Bonds3

About 2-(6-methoxy-3-pyridinyl)ethanamine

2-(6-methoxy-3-pyridinyl)ethanamine (PubChem CID 53407550) has the molecular formula C8H12N2O and a molecular weight of 152.20 g/mol. Its IUPAC name is 2-(6-methoxy-3-pyridinyl)ethanamine.

Molecular Properties

Compound Name2-(6-methoxy-3-pyridinyl)ethanamine
PubChem CID53407550
Molecular FormulaC8H12N2O
Molecular Weight152.20 g/mol
Exact Mass152.09
IUPAC Name2-(6-methoxy-3-pyridinyl)ethanamine
SMILESCOc1ccc(CCN)cn1
InChIInChI=1S/C8H12N2O/c1-11-8-3-2-7(4-5-9)6-10-8/h2-3,6H,4-5,9H2,1H3
InChIKeyYNLWLBAHWMOFBQ-UHFFFAOYSA-N
XLogP0.59
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.20
LogP ≤ 50.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(6-methoxy-3-pyridinyl)ethanamine?
The IUPAC name of 2-(6-methoxy-3-pyridinyl)ethanamine (CID 53407550) is 2-(6-methoxy-3-pyridinyl)ethanamine.
What is the SMILES notation for 2-(6-methoxy-3-pyridinyl)ethanamine?
The canonical SMILES for 2-(6-methoxy-3-pyridinyl)ethanamine is COc1ccc(CCN)cn1.
What is the InChIKey of 2-(6-methoxy-3-pyridinyl)ethanamine?
The InChIKey is YNLWLBAHWMOFBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N2O/c1-11-8-3-2-7(4-5-9)6-10-8/h2-3,6H,4-5,9H2,1H3.
What are the key properties of 2-(6-methoxy-3-pyridinyl)ethanamine?
2-(6-methoxy-3-pyridinyl)ethanamine has a molecular weight of 152.20 g/mol, XLogP of 0.59, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-methoxy-3-pyridinyl)ethanamine is sourced from PubChem (CID 53407550), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).