1-[3-(2-methoxyphenoxy)phenyl]propan-2-amine

C16H19NO2 — CID 63943521

IUPAC1-[3-(2-methoxyphenoxy)phenyl]propan-2-amine
SMILESCOc1ccccc1Oc1cccc(CC(C)N)c1
InChIInChI=1S/C16H19NO2/c1-12(17)10-13-6-5-7-14(11-13)19-16-9-4-3-8-15(16)18-2/h3-9,11-12H,10,17H2,1-2H3
InChIKeyMBHJHORYXKQUSL-UHFFFAOYSA-N
MW257.33 g/mol
LogP3.38
Rot. Bonds5

About 1-[3-(2-methoxyphenoxy)phenyl]propan-2-amine

1-[3-(2-methoxyphenoxy)phenyl]propan-2-amine (PubChem CID 63943521) has the molecular formula C16H19NO2 and a molecular weight of 257.33 g/mol. Its IUPAC name is 1-[3-(2-methoxyphenoxy)phenyl]propan-2-amine.

Molecular Properties

Compound Name1-[3-(2-methoxyphenoxy)phenyl]propan-2-amine
PubChem CID63943521
Molecular FormulaC16H19NO2
Molecular Weight257.33 g/mol
Exact Mass257.14
IUPAC Name1-[3-(2-methoxyphenoxy)phenyl]propan-2-amine
SMILESCOc1ccccc1Oc1cccc(CC(C)N)c1
InChIInChI=1S/C16H19NO2/c1-12(17)10-13-6-5-7-14(11-13)19-16-9-4-3-8-15(16)18-2/h3-9,11-12H,10,17H2,1-2H3
InChIKeyMBHJHORYXKQUSL-UHFFFAOYSA-N
XLogP3.38
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.33
LogP ≤ 53.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[3-(3,5-dimethoxyphenoxy)phenyl]propan-2-amine
CID 63941754
[3-(2-methoxyphenoxy)phenyl]methanol
CID 69315022
1-[3-fluoro-4-(2-methoxyphenoxy)phenyl]propan-2-amine
CID 63803801
1-[4-(2-methoxyphenoxy)-2-methylphenyl]propan-2-amine
CID 63803634
1-[3-(3-ethylphenoxy)phenyl]propan-2-amine
CID 63942734
1-[3-(2,4-dibromophenoxy)phenyl]propan-2-amine
CID 64713841
4-[3-(2-aminopropyl)phenoxy]aniline
CID 116996628
1-methoxy-2-(3-methoxyphenoxy)benzene
CID 14020526
1-[4-(3-ethylphenoxy)-3-methylphenyl]propan-2-amine
CID 63815930
1-[3-(3,5-difluorophenoxy)phenyl]propan-2-amine
CID 63943526
1-[2-chloro-6-(3-ethylphenoxy)phenyl]propan-2-amine
CID 63815753
1-[3-(methoxymethoxy)phenyl]propan-2-amine
CID 55253645

Frequently Asked Questions

What is the IUPAC name of 1-[3-(2-methoxyphenoxy)phenyl]propan-2-amine?
The IUPAC name of 1-[3-(2-methoxyphenoxy)phenyl]propan-2-amine (CID 63943521) is 1-[3-(2-methoxyphenoxy)phenyl]propan-2-amine.
What is the SMILES notation for 1-[3-(2-methoxyphenoxy)phenyl]propan-2-amine?
The canonical SMILES for 1-[3-(2-methoxyphenoxy)phenyl]propan-2-amine is COc1ccccc1Oc1cccc(CC(C)N)c1.
What is the InChIKey of 1-[3-(2-methoxyphenoxy)phenyl]propan-2-amine?
The InChIKey is MBHJHORYXKQUSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19NO2/c1-12(17)10-13-6-5-7-14(11-13)19-16-9-4-3-8-15(16)18-2/h3-9,11-12H,10,17H2,1-2H3.
What are the key properties of 1-[3-(2-methoxyphenoxy)phenyl]propan-2-amine?
1-[3-(2-methoxyphenoxy)phenyl]propan-2-amine has a molecular weight of 257.33 g/mol, XLogP of 3.38, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-(2-methoxyphenoxy)phenyl]propan-2-amine is sourced from PubChem (CID 63943521), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).