2-methoxy-1-pyridin-2-ylethanamine;hydrochloride

C8H13ClN2O — CID 53398961

IUPAC2-methoxy-1-pyridin-2-ylethanamine;hydrochloride
SMILESCOCC(N)c1ccccn1.Cl
InChIInChI=1S/C8H12N2O.ClH/c1-11-6-7(9)8-4-2-3-5-10-8;/h2-5,7H,6,9H2,1H3;1H
InChIKeyLFQPQRBPIFHJHL-UHFFFAOYSA-N
MW188.66 g/mol
LogP1.15
Rot. Bonds3

About 2-methoxy-1-pyridin-2-ylethanamine;hydrochloride

2-methoxy-1-pyridin-2-ylethanamine;hydrochloride (PubChem CID 53398961) has the molecular formula C8H13ClN2O and a molecular weight of 188.66 g/mol. Its IUPAC name is 2-methoxy-1-pyridin-2-ylethanamine;hydrochloride.

Molecular Properties

Compound Name2-methoxy-1-pyridin-2-ylethanamine;hydrochloride
PubChem CID53398961
Molecular FormulaC8H13ClN2O
Molecular Weight188.66 g/mol
Exact Mass188.07
IUPAC Name2-methoxy-1-pyridin-2-ylethanamine;hydrochloride
SMILESCOCC(N)c1ccccn1.Cl
InChIInChI=1S/C8H12N2O.ClH/c1-11-6-7(9)8-4-2-3-5-10-8;/h2-5,7H,6,9H2,1H3;1H
InChIKeyLFQPQRBPIFHJHL-UHFFFAOYSA-N
XLogP1.15
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.66
LogP ≤ 51.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(1S)-1-pyridin-2-ylpropan-1-amine;dihydrochloride
CID 122236499
2-(3-methoxyphenoxy)-1-pyridin-2-ylethanamine
CID 117241389
(2R)-2-amino-2-pyridin-2-ylethanol;hydrochloride
CID 86306039
(2-amino-2-pyridin-2-ylethyl) pyridine-2-carboxylate;hydrochloride
CID 174448756
1-(6-chloro-2-pyridinyl)-2-methoxyethanamine
CID 55272790
2-(2-methoxy-1-methylsulfanylethyl)pyridine
CID 146229579
(2S)-2-amino-2-pyridin-2-ylethanol
CID 55278064
(1S)-3,3-dimethyl-1-pyridin-2-ylbutan-1-amine
CID 99737676
(1S)-2-methoxy-1-(3-methyl-2-pyridinyl)ethanamine
CID 55293686
6-[(1S)-1-amino-2-methoxyethyl]pyridin-3-ol
CID 55293682
(1R)-2-methyl-1-pyridin-2-ylpropan-1-amine;dihydrochloride
CID 86767543
(1R)-2-(4-methylphenyl)-1-pyridin-2-ylethanamine
CID 93312466

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-1-pyridin-2-ylethanamine;hydrochloride?
The IUPAC name of 2-methoxy-1-pyridin-2-ylethanamine;hydrochloride (CID 53398961) is 2-methoxy-1-pyridin-2-ylethanamine;hydrochloride.
What is the SMILES notation for 2-methoxy-1-pyridin-2-ylethanamine;hydrochloride?
The canonical SMILES for 2-methoxy-1-pyridin-2-ylethanamine;hydrochloride is COCC(N)c1ccccn1.Cl.
What is the InChIKey of 2-methoxy-1-pyridin-2-ylethanamine;hydrochloride?
The InChIKey is LFQPQRBPIFHJHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N2O.ClH/c1-11-6-7(9)8-4-2-3-5-10-8;/h2-5,7H,6,9H2,1H3;1H.
What are the key properties of 2-methoxy-1-pyridin-2-ylethanamine;hydrochloride?
2-methoxy-1-pyridin-2-ylethanamine;hydrochloride has a molecular weight of 188.66 g/mol, XLogP of 1.15, 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-2-ylethanamine;hydrochloride is sourced from PubChem (CID 53398961), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).