2-methoxy-1-pyridin-4-ylethanamine

C8H12N2O — CID 55291789

IUPAC2-methoxy-1-pyridin-4-ylethanamine
SMILESCOCC(N)c1ccncc1
InChIInChI=1S/C8H12N2O/c1-11-6-8(9)7-2-4-10-5-3-7/h2-5,8H,6,9H2,1H3
InChIKeyWPAZIGDNUANDSC-UHFFFAOYSA-N
MW152.20 g/mol
LogP0.73
Rot. Bonds3

About 2-methoxy-1-pyridin-4-ylethanamine

2-methoxy-1-pyridin-4-ylethanamine (PubChem CID 55291789) has the molecular formula C8H12N2O and a molecular weight of 152.20 g/mol. Its IUPAC name is 2-methoxy-1-pyridin-4-ylethanamine.

Molecular Properties

Compound Name2-methoxy-1-pyridin-4-ylethanamine
PubChem CID55291789
Molecular FormulaC8H12N2O
Molecular Weight152.20 g/mol
Exact Mass152.09
IUPAC Name2-methoxy-1-pyridin-4-ylethanamine
SMILESCOCC(N)c1ccncc1
InChIInChI=1S/C8H12N2O/c1-11-6-8(9)7-2-4-10-5-3-7/h2-5,8H,6,9H2,1H3
InChIKeyWPAZIGDNUANDSC-UHFFFAOYSA-N
XLogP0.73
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 ≤ 50.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methoxy-1-pyridin-4-ylethanamine?
The IUPAC name of 2-methoxy-1-pyridin-4-ylethanamine (CID 55291789) is 2-methoxy-1-pyridin-4-ylethanamine.
What is the SMILES notation for 2-methoxy-1-pyridin-4-ylethanamine?
The canonical SMILES for 2-methoxy-1-pyridin-4-ylethanamine is COCC(N)c1ccncc1.
What is the InChIKey of 2-methoxy-1-pyridin-4-ylethanamine?
The InChIKey is WPAZIGDNUANDSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N2O/c1-11-6-8(9)7-2-4-10-5-3-7/h2-5,8H,6,9H2,1H3.
What are the key properties of 2-methoxy-1-pyridin-4-ylethanamine?
2-methoxy-1-pyridin-4-ylethanamine has a molecular weight of 152.20 g/mol, XLogP of 0.73, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-1-pyridin-4-ylethanamine is sourced from PubChem (CID 55291789), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).