6-(2-bromo-4-methoxyphenoxy)-2-propan-2-yloxypyridin-3-amine

C15H17BrN2O3 — CID 104706569

IUPAC6-(2-bromo-4-methoxyphenoxy)-2-propan-2-yloxypyridin-3-amine
SMILESCOc1ccc(Oc2ccc(N)c(OC(C)C)n2)c(Br)c1
InChIInChI=1S/C15H17BrN2O3/c1-9(2)20-15-12(17)5-7-14(18-15)21-13-6-4-10(19-3)8-11(13)16/h4-9H,17H2,1-3H3
InChIKeySFKJXTVXSYSJLO-UHFFFAOYSA-N
MW353.22 g/mol
LogP4.01
Rot. Bonds5

About 6-(2-bromo-4-methoxyphenoxy)-2-propan-2-yloxypyridin-3-amine

6-(2-bromo-4-methoxyphenoxy)-2-propan-2-yloxypyridin-3-amine (PubChem CID 104706569) has the molecular formula C15H17BrN2O3 and a molecular weight of 353.22 g/mol. Its IUPAC name is 6-(2-bromo-4-methoxyphenoxy)-2-propan-2-yloxypyridin-3-amine.

Molecular Properties

Compound Name6-(2-bromo-4-methoxyphenoxy)-2-propan-2-yloxypyridin-3-amine
PubChem CID104706569
Molecular FormulaC15H17BrN2O3
Molecular Weight353.22 g/mol
Exact Mass352.04
IUPAC Name6-(2-bromo-4-methoxyphenoxy)-2-propan-2-yloxypyridin-3-amine
SMILESCOc1ccc(Oc2ccc(N)c(OC(C)C)n2)c(Br)c1
InChIInChI=1S/C15H17BrN2O3/c1-9(2)20-15-12(17)5-7-14(18-15)21-13-6-4-10(19-3)8-11(13)16/h4-9H,17H2,1-3H3
InChIKeySFKJXTVXSYSJLO-UHFFFAOYSA-N
XLogP4.01
TPSA66.60 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.22
LogP ≤ 54.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

6-(4-bromo-3-methylphenoxy)-2-propan-2-yloxypyridin-3-amine
CID 83133166
6-(4-bromo-3,5-dimethylphenoxy)-2-propan-2-yloxypyridin-3-amine
CID 107722526
6-(2,4-dichlorophenoxy)-2-propan-2-yloxypyridin-3-amine
CID 43262152
6-(3,5-difluorophenoxy)-2-propan-2-yloxypyridin-3-amine
CID 62784272
5-amino-6-(2-bromo-4-methoxyphenoxy)pyridine-2-carboxamide
CID 114409213
6-(4-bromo-2-propan-2-ylphenoxy)-2-methoxypyridin-3-amine
CID 115401558
6-(2-chloro-5-methylphenoxy)-2-propan-2-yloxypyridin-3-amine
CID 43262611
6-(2-bromo-4-methoxyphenoxy)pyridin-3-amine
CID 104706426
5-(2-bromo-4-methoxyphenoxy)pyrazin-2-amine
CID 104708756
4-[(5-amino-6-propan-2-yloxy-2-pyridinyl)oxy]benzonitrile
CID 43262138
[6-(2-bromo-4-methoxyphenoxy)-2-pyridinyl]methanamine
CID 113443515
6-(2,3-difluorophenoxy)-2-propan-2-yloxypyridin-3-amine
CID 63037603

Frequently Asked Questions

What is the IUPAC name of 6-(2-bromo-4-methoxyphenoxy)-2-propan-2-yloxypyridin-3-amine?
The IUPAC name of 6-(2-bromo-4-methoxyphenoxy)-2-propan-2-yloxypyridin-3-amine (CID 104706569) is 6-(2-bromo-4-methoxyphenoxy)-2-propan-2-yloxypyridin-3-amine.
What is the SMILES notation for 6-(2-bromo-4-methoxyphenoxy)-2-propan-2-yloxypyridin-3-amine?
The canonical SMILES for 6-(2-bromo-4-methoxyphenoxy)-2-propan-2-yloxypyridin-3-amine is COc1ccc(Oc2ccc(N)c(OC(C)C)n2)c(Br)c1.
What is the InChIKey of 6-(2-bromo-4-methoxyphenoxy)-2-propan-2-yloxypyridin-3-amine?
The InChIKey is SFKJXTVXSYSJLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17BrN2O3/c1-9(2)20-15-12(17)5-7-14(18-15)21-13-6-4-10(19-3)8-11(13)16/h4-9H,17H2,1-3H3.
What are the key properties of 6-(2-bromo-4-methoxyphenoxy)-2-propan-2-yloxypyridin-3-amine?
6-(2-bromo-4-methoxyphenoxy)-2-propan-2-yloxypyridin-3-amine has a molecular weight of 353.22 g/mol, XLogP of 4.01, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-bromo-4-methoxyphenoxy)-2-propan-2-yloxypyridin-3-amine is sourced from PubChem (CID 104706569), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).