2-(2-methoxyphenoxy)-N-(pyridin-3-ylmethyl)propan-1-amine

C16H20N2O2 — CID 54803196

IUPAC2-(2-methoxyphenoxy)-N-(pyridin-3-ylmethyl)propan-1-amine
SMILESCOc1ccccc1OC(C)CNCc1cccnc1
InChIInChI=1S/C16H20N2O2/c1-13(10-18-12-14-6-5-9-17-11-14)20-16-8-4-3-7-15(16)19-2/h3-9,11,13,18H,10,12H2,1-2H3
InChIKeyKYOAUYNKZSWAMO-UHFFFAOYSA-N
MW272.35 g/mol
LogP2.65
Rot. Bonds7

About 2-(2-methoxyphenoxy)-N-(pyridin-3-ylmethyl)propan-1-amine

2-(2-methoxyphenoxy)-N-(pyridin-3-ylmethyl)propan-1-amine (PubChem CID 54803196) has the molecular formula C16H20N2O2 and a molecular weight of 272.35 g/mol. Its IUPAC name is 2-(2-methoxyphenoxy)-N-(pyridin-3-ylmethyl)propan-1-amine.

Molecular Properties

Compound Name2-(2-methoxyphenoxy)-N-(pyridin-3-ylmethyl)propan-1-amine
PubChem CID54803196
Molecular FormulaC16H20N2O2
Molecular Weight272.35 g/mol
Exact Mass272.15
IUPAC Name2-(2-methoxyphenoxy)-N-(pyridin-3-ylmethyl)propan-1-amine
SMILESCOc1ccccc1OC(C)CNCc1cccnc1
InChIInChI=1S/C16H20N2O2/c1-13(10-18-12-14-6-5-9-17-11-14)20-16-8-4-3-7-15(16)19-2/h3-9,11,13,18H,10,12H2,1-2H3
InChIKeyKYOAUYNKZSWAMO-UHFFFAOYSA-N
XLogP2.65
TPSA43.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(4-methoxyphenoxy)-N-(pyridin-3-ylmethyl)propan-1-amine
CID 54803190
methyl (2S)-2-methyl-3-(pyridin-3-ylmethylamino)propanoate
CID 93035167
N-[(2-methoxyphenyl)methyl]-1-pyridin-3-ylmethanamine;oxalic acid
CID 17367682
N-[[2-(difluoromethoxy)-3-methoxyphenyl]methyl]-1-pyridin-3-ylmethanamine
CID 43406252
2-methyl-3-(pyridin-3-ylmethylamino)propanenitrile
CID 43242702
1-ethyl-2-[2-(2-methoxyphenoxy)propyl]-3-(2-pyridin-3-ylethyl)guanidine
CID 111682280
1-(3-butoxy-4-methoxyphenyl)-N-(pyridin-3-ylmethyl)methanamine
CID 39423559
2-[2-(2-methoxyphenoxy)propanoylamino]-N-(pyridin-3-ylmethyl)benzamide
CID 6498921
N-[2-(2-methoxyphenoxy)propyl]pentan-1-amine
CID 62572608
1-pyridin-3-yl-N-[(2,3,4-trimethoxyphenyl)methyl]methanamine
CID 1075948
N-[(3-methoxy-2-phenylmethoxyphenyl)methyl]-1-pyridin-3-ylmethanamine chloride
CID 53350927
1-(pyridin-3-ylmethylamino)butan-2-ol
CID 18726795

Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxyphenoxy)-N-(pyridin-3-ylmethyl)propan-1-amine?
The IUPAC name of 2-(2-methoxyphenoxy)-N-(pyridin-3-ylmethyl)propan-1-amine (CID 54803196) is 2-(2-methoxyphenoxy)-N-(pyridin-3-ylmethyl)propan-1-amine.
What is the SMILES notation for 2-(2-methoxyphenoxy)-N-(pyridin-3-ylmethyl)propan-1-amine?
The canonical SMILES for 2-(2-methoxyphenoxy)-N-(pyridin-3-ylmethyl)propan-1-amine is COc1ccccc1OC(C)CNCc1cccnc1.
What is the InChIKey of 2-(2-methoxyphenoxy)-N-(pyridin-3-ylmethyl)propan-1-amine?
The InChIKey is KYOAUYNKZSWAMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O2/c1-13(10-18-12-14-6-5-9-17-11-14)20-16-8-4-3-7-15(16)19-2/h3-9,11,13,18H,10,12H2,1-2H3.
What are the key properties of 2-(2-methoxyphenoxy)-N-(pyridin-3-ylmethyl)propan-1-amine?
2-(2-methoxyphenoxy)-N-(pyridin-3-ylmethyl)propan-1-amine has a molecular weight of 272.35 g/mol, XLogP of 2.65, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyphenoxy)-N-(pyridin-3-ylmethyl)propan-1-amine is sourced from PubChem (CID 54803196), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).