(1R)-1-(3-methoxyphenyl)-N-[[3-(pyridin-2-ylmethoxy)phenyl]methyl]ethanamine

C22H24N2O2 — CID 59803177

IUPAC(1R)-1-(3-methoxyphenyl)-N-[[3-(pyridin-2-ylmethoxy)phenyl]methyl]ethanamine
SMILESCOc1cccc([C@@H](C)NCc2cccc(OCc3ccccn3)c2)c1
InChIInChI=1S/C22H24N2O2/c1-17(19-8-6-10-21(14-19)25-2)24-15-18-7-5-11-22(13-18)26-16-20-9-3-4-12-23-20/h3-14,17,24H,15-16H2,1-2H3/t17-/m1/s1
InChIKeyGZSLTRDZOOSGGJ-QGZVFWFLSA-N
MW348.45 g/mol
LogP4.52
Rot. Bonds8

About (1R)-1-(3-methoxyphenyl)-N-[[3-(pyridin-2-ylmethoxy)phenyl]methyl]ethanamine

(1R)-1-(3-methoxyphenyl)-N-[[3-(pyridin-2-ylmethoxy)phenyl]methyl]ethanamine (PubChem CID 59803177) has the molecular formula C22H24N2O2 and a molecular weight of 348.45 g/mol. Its IUPAC name is (1R)-1-(3-methoxyphenyl)-N-[[3-(pyridin-2-ylmethoxy)phenyl]methyl]ethanamine.

Molecular Properties

Compound Name(1R)-1-(3-methoxyphenyl)-N-[[3-(pyridin-2-ylmethoxy)phenyl]methyl]ethanamine
PubChem CID59803177
Molecular FormulaC22H24N2O2
Molecular Weight348.45 g/mol
Exact Mass348.18
IUPAC Name(1R)-1-(3-methoxyphenyl)-N-[[3-(pyridin-2-ylmethoxy)phenyl]methyl]ethanamine
SMILESCOc1cccc([C@@H](C)NCc2cccc(OCc3ccccn3)c2)c1
InChIInChI=1S/C22H24N2O2/c1-17(19-8-6-10-21(14-19)25-2)24-15-18-7-5-11-22(13-18)26-16-20-9-3-4-12-23-20/h3-14,17,24H,15-16H2,1-2H3/t17-/m1/s1
InChIKeyGZSLTRDZOOSGGJ-QGZVFWFLSA-N
XLogP4.52
TPSA43.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.45
LogP ≤ 54.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze (1R)-1-(3-methoxyphenyl)-N-[[3-(pyridin-2-ylmethoxy)phenyl]methyl]ethanamine with MolForge

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Related Compounds

4-[[[(1R)-1-[3-(pyridin-2-ylmethoxy)phenyl]ethyl]amino]methyl]pyridin-2-amine
CID 99838870
1-(3-methoxyphenyl)-N-(2-pyridin-2-ylethyl)ethanamine
CID 43193663
(1R)-1-(3-chlorophenyl)-N-[(3-methoxyphenyl)methyl]ethanamine
CID 28649459
(1S)-1-(3-chlorophenyl)-N-[(3-methoxyphenyl)methyl]ethanamine
CID 28649457
(2S)-2-[(3-methoxyphenyl)methylamino]-3-pyridin-2-ylpropan-1-ol
CID 122589547
(1R)-N-[(3,4-dichlorophenyl)methyl]-1-(3-methoxyphenyl)ethanamine
CID 81376275
1-(3-methoxyphenyl)-N-[(3-pyrazin-2-ylphenyl)methyl]ethanamine
CID 22391578
2-(4-methoxyphenyl)-N-[[3-(pyridin-2-ylmethoxy)phenyl]methyl]-2-pyrrolidin-1-ylethanamine
CID 47030410
N-[(3-methoxyphenyl)methyl]-1-(4-propan-2-ylphenyl)ethanamine
CID 43221152
1-(3-methoxyphenyl)-N-(pyridazin-3-ylmethyl)ethanamine
CID 106895169
1-[2-(3-methoxyphenoxy)propyl]-2-methyl-3-[[3-(pyridin-2-ylmethoxy)phenyl]methyl]guanidine
CID 111679708
(1R)-N-[[3-(pyridin-2-ylmethoxy)phenyl]methyl]-1-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)ethanamine
CID 95282173

Frequently Asked Questions

What is the IUPAC name of (1R)-1-(3-methoxyphenyl)-N-[[3-(pyridin-2-ylmethoxy)phenyl]methyl]ethanamine?
The IUPAC name of (1R)-1-(3-methoxyphenyl)-N-[[3-(pyridin-2-ylmethoxy)phenyl]methyl]ethanamine (CID 59803177) is (1R)-1-(3-methoxyphenyl)-N-[[3-(pyridin-2-ylmethoxy)phenyl]methyl]ethanamine.
What is the SMILES notation for (1R)-1-(3-methoxyphenyl)-N-[[3-(pyridin-2-ylmethoxy)phenyl]methyl]ethanamine?
The canonical SMILES for (1R)-1-(3-methoxyphenyl)-N-[[3-(pyridin-2-ylmethoxy)phenyl]methyl]ethanamine is COc1cccc([C@@H](C)NCc2cccc(OCc3ccccn3)c2)c1.
What is the InChIKey of (1R)-1-(3-methoxyphenyl)-N-[[3-(pyridin-2-ylmethoxy)phenyl]methyl]ethanamine?
The InChIKey is GZSLTRDZOOSGGJ-QGZVFWFLSA-N. The full InChI is InChI=1S/C22H24N2O2/c1-17(19-8-6-10-21(14-19)25-2)24-15-18-7-5-11-22(13-18)26-16-20-9-3-4-12-23-20/h3-14,17,24H,15-16H2,1-2H3/t17-/m1/s1.
What are the key properties of (1R)-1-(3-methoxyphenyl)-N-[[3-(pyridin-2-ylmethoxy)phenyl]methyl]ethanamine?
(1R)-1-(3-methoxyphenyl)-N-[[3-(pyridin-2-ylmethoxy)phenyl]methyl]ethanamine has a molecular weight of 348.45 g/mol, XLogP of 4.52, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-(3-methoxyphenyl)-N-[[3-(pyridin-2-ylmethoxy)phenyl]methyl]ethanamine is sourced from PubChem (CID 59803177), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).