1-(3-methoxyphenyl)-N-(2-pyridin-2-ylethyl)ethanamine

C16H20N2O — CID 43193663

IUPAC1-(3-methoxyphenyl)-N-(2-pyridin-2-ylethyl)ethanamine
SMILESCOc1cccc(C(C)NCCc2ccccn2)c1
InChIInChI=1S/C16H20N2O/c1-13(14-6-5-8-16(12-14)19-2)17-11-9-15-7-3-4-10-18-15/h3-8,10,12-13,17H,9,11H2,1-2H3
InChIKeyFKDJSZIUJBHWIW-UHFFFAOYSA-N
MW256.35 g/mol
LogP2.98
Rot. Bonds6

About 1-(3-methoxyphenyl)-N-(2-pyridin-2-ylethyl)ethanamine

1-(3-methoxyphenyl)-N-(2-pyridin-2-ylethyl)ethanamine (PubChem CID 43193663) has the molecular formula C16H20N2O and a molecular weight of 256.35 g/mol. Its IUPAC name is 1-(3-methoxyphenyl)-N-(2-pyridin-2-ylethyl)ethanamine.

Molecular Properties

Compound Name1-(3-methoxyphenyl)-N-(2-pyridin-2-ylethyl)ethanamine
PubChem CID43193663
Molecular FormulaC16H20N2O
Molecular Weight256.35 g/mol
Exact Mass256.16
IUPAC Name1-(3-methoxyphenyl)-N-(2-pyridin-2-ylethyl)ethanamine
SMILESCOc1cccc(C(C)NCCc2ccccn2)c1
InChIInChI=1S/C16H20N2O/c1-13(14-6-5-8-16(12-14)19-2)17-11-9-15-7-3-4-10-18-15/h3-8,10,12-13,17H,9,11H2,1-2H3
InChIKeyFKDJSZIUJBHWIW-UHFFFAOYSA-N
XLogP2.98
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 52.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(1R)-1-(3-methoxyphenyl)-N-[[3-(pyridin-2-ylmethoxy)phenyl]methyl]ethanamine
CID 59803177
4-methoxy-2-[1-(2-pyridin-2-ylethylamino)ethyl]phenol
CID 43193672
1-(3-methoxyphenyl)-N-[2-(1-methylimidazol-2-yl)ethyl]ethanamine
CID 61214144
N-[1-(3-methoxyphenyl)ethyl]-3-methylbutan-1-amine
CID 43193047
2-(3-methoxyphenyl)-N-(2-pyridin-2-ylethyl)ethanamine
CID 107852157
N-[1-(3-methoxyphenyl)ethyl]-3-phenylpropan-1-amine
CID 18357750
(1S)-N-[2-(4-methoxyphenoxy)ethyl]-1-(3-methoxyphenyl)ethanamine
CID 95972955
N-[2-(4-fluorophenyl)ethyl]-1-(3-methoxyphenyl)ethanamine
CID 43191768
N-[(1S)-1-(3-methoxyphenyl)ethyl]-4-phenylbutan-1-amine
CID 104893847
1-(3-methoxyphenyl)-N-(pyridazin-3-ylmethyl)ethanamine
CID 106895169
1-(3-methoxyphenyl)-N-(2-phenylsulfanylethyl)ethanamine
CID 60976496
(1S)-1-(3-methoxyphenyl)-N-[(3-methyl-2-pyridinyl)methyl]ethanamine
CID 95396037

Frequently Asked Questions

What is the IUPAC name of 1-(3-methoxyphenyl)-N-(2-pyridin-2-ylethyl)ethanamine?
The IUPAC name of 1-(3-methoxyphenyl)-N-(2-pyridin-2-ylethyl)ethanamine (CID 43193663) is 1-(3-methoxyphenyl)-N-(2-pyridin-2-ylethyl)ethanamine.
What is the SMILES notation for 1-(3-methoxyphenyl)-N-(2-pyridin-2-ylethyl)ethanamine?
The canonical SMILES for 1-(3-methoxyphenyl)-N-(2-pyridin-2-ylethyl)ethanamine is COc1cccc(C(C)NCCc2ccccn2)c1.
What is the InChIKey of 1-(3-methoxyphenyl)-N-(2-pyridin-2-ylethyl)ethanamine?
The InChIKey is FKDJSZIUJBHWIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O/c1-13(14-6-5-8-16(12-14)19-2)17-11-9-15-7-3-4-10-18-15/h3-8,10,12-13,17H,9,11H2,1-2H3.
What are the key properties of 1-(3-methoxyphenyl)-N-(2-pyridin-2-ylethyl)ethanamine?
1-(3-methoxyphenyl)-N-(2-pyridin-2-ylethyl)ethanamine has a molecular weight of 256.35 g/mol, XLogP of 2.98, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-methoxyphenyl)-N-(2-pyridin-2-ylethyl)ethanamine is sourced from PubChem (CID 43193663), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).