1-[5-(3-methoxyphenoxy)-2-pyridinyl]propan-1-amine

C15H18N2O2 — CID 112584748

IUPAC1-[5-(3-methoxyphenoxy)-2-pyridinyl]propan-1-amine
SMILESCCC(N)c1ccc(Oc2cccc(OC)c2)cn1
InChIInChI=1S/C15H18N2O2/c1-3-14(16)15-8-7-13(10-17-15)19-12-6-4-5-11(9-12)18-2/h4-10,14H,3,16H2,1-2H3
InChIKeyAWOYADADBCLXEZ-UHFFFAOYSA-N
MW258.32 g/mol
LogP3.29
Rot. Bonds5

About 1-[5-(3-methoxyphenoxy)-2-pyridinyl]propan-1-amine

1-[5-(3-methoxyphenoxy)-2-pyridinyl]propan-1-amine (PubChem CID 112584748) has the molecular formula C15H18N2O2 and a molecular weight of 258.32 g/mol. Its IUPAC name is 1-[5-(3-methoxyphenoxy)-2-pyridinyl]propan-1-amine.

Molecular Properties

Compound Name1-[5-(3-methoxyphenoxy)-2-pyridinyl]propan-1-amine
PubChem CID112584748
Molecular FormulaC15H18N2O2
Molecular Weight258.32 g/mol
Exact Mass258.14
IUPAC Name1-[5-(3-methoxyphenoxy)-2-pyridinyl]propan-1-amine
SMILESCCC(N)c1ccc(Oc2cccc(OC)c2)cn1
InChIInChI=1S/C15H18N2O2/c1-3-14(16)15-8-7-13(10-17-15)19-12-6-4-5-11(9-12)18-2/h4-10,14H,3,16H2,1-2H3
InChIKeyAWOYADADBCLXEZ-UHFFFAOYSA-N
XLogP3.29
TPSA57.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 53.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(1R)-1-[5-(3-methoxyphenoxy)-2-pyridinyl]propan-1-ol
CID 103939075
1-[5-(2-bromo-4-methoxyphenoxy)-2-pyridinyl]propan-1-amine
CID 104707911
(1S)-1-[5-(3-methyl-4-propan-2-ylphenoxy)-2-pyridinyl]propan-1-amine
CID 103937754
1-[5-(3-methoxyphenyl)sulfanyl-2-pyridinyl]propan-1-amine
CID 112585010
(1S)-1-[5-(3,5-dichlorophenoxy)-2-pyridinyl]propan-1-amine
CID 103937870
(1S)-1-[5-(4-bromophenoxy)-2-pyridinyl]propan-1-amine
CID 103937759
(1S)-1-[5-(4-iodophenoxy)-2-pyridinyl]propan-1-amine
CID 103937836
(1S)-1-[5-(4-chloro-3-fluorophenoxy)-2-pyridinyl]propan-1-amine
CID 103938051
1-[5-[4-(2-methoxyethyl)phenoxy]-2-pyridinyl]propan-1-amine
CID 115940032
(1S)-1-[5-(3-ethoxyphenoxy)-2-pyridinyl]propan-1-ol
CID 103939228
(1R)-1-[5-(2,3-dichlorophenoxy)-2-pyridinyl]propan-1-amine
CID 103937652
(1R)-1-[5-(2-methyl-5-propan-2-ylphenoxy)-2-pyridinyl]propan-1-amine
CID 103937883

Frequently Asked Questions

What is the IUPAC name of 1-[5-(3-methoxyphenoxy)-2-pyridinyl]propan-1-amine?
The IUPAC name of 1-[5-(3-methoxyphenoxy)-2-pyridinyl]propan-1-amine (CID 112584748) is 1-[5-(3-methoxyphenoxy)-2-pyridinyl]propan-1-amine.
What is the SMILES notation for 1-[5-(3-methoxyphenoxy)-2-pyridinyl]propan-1-amine?
The canonical SMILES for 1-[5-(3-methoxyphenoxy)-2-pyridinyl]propan-1-amine is CCC(N)c1ccc(Oc2cccc(OC)c2)cn1.
What is the InChIKey of 1-[5-(3-methoxyphenoxy)-2-pyridinyl]propan-1-amine?
The InChIKey is AWOYADADBCLXEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O2/c1-3-14(16)15-8-7-13(10-17-15)19-12-6-4-5-11(9-12)18-2/h4-10,14H,3,16H2,1-2H3.
What are the key properties of 1-[5-(3-methoxyphenoxy)-2-pyridinyl]propan-1-amine?
1-[5-(3-methoxyphenoxy)-2-pyridinyl]propan-1-amine has a molecular weight of 258.32 g/mol, XLogP of 3.29, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[5-(3-methoxyphenoxy)-2-pyridinyl]propan-1-amine is sourced from PubChem (CID 112584748), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).