3-(2-methoxyphenoxy)-2-pyridin-3-ylpropan-1-amine

C15H18N2O2 — CID 112516632

IUPAC3-(2-methoxyphenoxy)-2-pyridin-3-ylpropan-1-amine
SMILESCOc1ccccc1OCC(CN)c1cccnc1
InChIInChI=1S/C15H18N2O2/c1-18-14-6-2-3-7-15(14)19-11-13(9-16)12-5-4-8-17-10-12/h2-8,10,13H,9,11,16H2,1H3
InChIKeyVRWGPWIEZITDPS-UHFFFAOYSA-N
MW258.32 g/mol
LogP2.21
Rot. Bonds6

About 3-(2-methoxyphenoxy)-2-pyridin-3-ylpropan-1-amine

3-(2-methoxyphenoxy)-2-pyridin-3-ylpropan-1-amine (PubChem CID 112516632) has the molecular formula C15H18N2O2 and a molecular weight of 258.32 g/mol. Its IUPAC name is 3-(2-methoxyphenoxy)-2-pyridin-3-ylpropan-1-amine.

Molecular Properties

Compound Name3-(2-methoxyphenoxy)-2-pyridin-3-ylpropan-1-amine
PubChem CID112516632
Molecular FormulaC15H18N2O2
Molecular Weight258.32 g/mol
Exact Mass258.14
IUPAC Name3-(2-methoxyphenoxy)-2-pyridin-3-ylpropan-1-amine
SMILESCOc1ccccc1OCC(CN)c1cccnc1
InChIInChI=1S/C15H18N2O2/c1-18-14-6-2-3-7-15(14)19-11-13(9-16)12-5-4-8-17-10-12/h2-8,10,13H,9,11,16H2,1H3
InChIKeyVRWGPWIEZITDPS-UHFFFAOYSA-N
XLogP2.21
TPSA57.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2-methoxyphenyl)-3-pyridin-3-yloxypropan-1-amine
CID 117244112
2-(3-hydroxy-2-pyridin-3-ylpropoxy)phenol
CID 117241268
3-(3-amino-2-pyridin-3-ylpropoxy)phenol
CID 117241277
2-[1-amino-3-(2-methoxyphenoxy)propan-2-yl]phenol
CID 117243992
2-(2-methoxyphenyl)-1-pyridin-3-ylethanamine
CID 22299211
2-pyridin-3-yl-3-[2-(trifluoromethyl)phenoxy]propan-1-ol
CID 117241260
[3-(2-methoxyphenoxy)-2-(pyridine-3-carbonyloxy)propyl] pyridine-3-carboxylate
CID 29237
3-(2-ethylphenoxy)-2-phenylpropan-1-amine
CID 112516482
methyl 3-(2-methylphenoxy)-2-pyridin-3-ylpropanoate
CID 117241320
2-[3-amino-2-(4-methoxyphenyl)propoxy]phenol
CID 117244895
3-methoxy-2-pyridin-3-ylpropan-1-ol
CID 117241293
3-(2-bromophenoxy)-2-phenylpropan-1-amine
CID 117242959

Frequently Asked Questions

What is the IUPAC name of 3-(2-methoxyphenoxy)-2-pyridin-3-ylpropan-1-amine?
The IUPAC name of 3-(2-methoxyphenoxy)-2-pyridin-3-ylpropan-1-amine (CID 112516632) is 3-(2-methoxyphenoxy)-2-pyridin-3-ylpropan-1-amine.
What is the SMILES notation for 3-(2-methoxyphenoxy)-2-pyridin-3-ylpropan-1-amine?
The canonical SMILES for 3-(2-methoxyphenoxy)-2-pyridin-3-ylpropan-1-amine is COc1ccccc1OCC(CN)c1cccnc1.
What is the InChIKey of 3-(2-methoxyphenoxy)-2-pyridin-3-ylpropan-1-amine?
The InChIKey is VRWGPWIEZITDPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O2/c1-18-14-6-2-3-7-15(14)19-11-13(9-16)12-5-4-8-17-10-12/h2-8,10,13H,9,11,16H2,1H3.
What are the key properties of 3-(2-methoxyphenoxy)-2-pyridin-3-ylpropan-1-amine?
3-(2-methoxyphenoxy)-2-pyridin-3-ylpropan-1-amine has a molecular weight of 258.32 g/mol, XLogP of 2.21, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methoxyphenoxy)-2-pyridin-3-ylpropan-1-amine is sourced from PubChem (CID 112516632), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).