5-bromo-2-(3,5-dimethoxyphenoxy)pyridin-3-amine

C13H13BrN2O3 — CID 61227912

IUPAC5-bromo-2-(3,5-dimethoxyphenoxy)pyridin-3-amine
SMILESCOc1cc(OC)cc(Oc2ncc(Br)cc2N)c1
InChIInChI=1S/C13H13BrN2O3/c1-17-9-4-10(18-2)6-11(5-9)19-13-12(15)3-8(14)7-16-13/h3-7H,15H2,1-2H3
InChIKeyWEAPZVDSNJZIRQ-UHFFFAOYSA-N
MW325.16 g/mol
LogP3.24
Rot. Bonds4

About 5-bromo-2-(3,5-dimethoxyphenoxy)pyridin-3-amine

5-bromo-2-(3,5-dimethoxyphenoxy)pyridin-3-amine (PubChem CID 61227912) has the molecular formula C13H13BrN2O3 and a molecular weight of 325.16 g/mol. Its IUPAC name is 5-bromo-2-(3,5-dimethoxyphenoxy)pyridin-3-amine.

Molecular Properties

Compound Name5-bromo-2-(3,5-dimethoxyphenoxy)pyridin-3-amine
PubChem CID61227912
Molecular FormulaC13H13BrN2O3
Molecular Weight325.16 g/mol
Exact Mass324.01
IUPAC Name5-bromo-2-(3,5-dimethoxyphenoxy)pyridin-3-amine
SMILESCOc1cc(OC)cc(Oc2ncc(Br)cc2N)c1
InChIInChI=1S/C13H13BrN2O3/c1-17-9-4-10(18-2)6-11(5-9)19-13-12(15)3-8(14)7-16-13/h3-7H,15H2,1-2H3
InChIKeyWEAPZVDSNJZIRQ-UHFFFAOYSA-N
XLogP3.24
TPSA66.60 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.16
LogP ≤ 53.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-[(3-amino-5-bromo-2-pyridinyl)oxy]-5-methoxybenzonitrile
CID 103566354
2-(3,5-dimethoxyphenoxy)-5-methylpyridin-3-amine
CID 66278697
5-bromo-2-(3-bromophenoxy)pyridin-3-amine
CID 61228290
[5-bromo-2-(3,5-dimethoxyphenoxy)-3-pyridinyl]methanol
CID 62001135
5-bromo-2-(2,6-dimethoxyphenoxy)pyridin-3-amine
CID 61227895
3-[(5-bromo-3-methyl-2-pyridinyl)oxy]-5-methoxybenzamide
CID 103568126
5-bromo-2-[(3-methoxyphenyl)methoxy]pyridin-3-amine
CID 61227713
5-bromo-2-[(5-methyl-1H-pyrazol-3-yl)oxy]pyridin-3-amine
CID 81341926
2-[(3,5-dibromo-2-pyridinyl)oxy]-5-methoxyaniline
CID 113413727
5-bromo-2-(2,3,6-trimethylphenoxy)pyridin-3-amine
CID 63458099
5-bromo-2-(2,4-dichlorophenoxy)pyridin-3-amine
CID 61228293
5-bromo-2-(3-cyano-5-methoxyphenoxy)pyridine-3-carboxylic acid
CID 103566598

Frequently Asked Questions

What is the IUPAC name of 5-bromo-2-(3,5-dimethoxyphenoxy)pyridin-3-amine?
The IUPAC name of 5-bromo-2-(3,5-dimethoxyphenoxy)pyridin-3-amine (CID 61227912) is 5-bromo-2-(3,5-dimethoxyphenoxy)pyridin-3-amine.
What is the SMILES notation for 5-bromo-2-(3,5-dimethoxyphenoxy)pyridin-3-amine?
The canonical SMILES for 5-bromo-2-(3,5-dimethoxyphenoxy)pyridin-3-amine is COc1cc(OC)cc(Oc2ncc(Br)cc2N)c1.
What is the InChIKey of 5-bromo-2-(3,5-dimethoxyphenoxy)pyridin-3-amine?
The InChIKey is WEAPZVDSNJZIRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13BrN2O3/c1-17-9-4-10(18-2)6-11(5-9)19-13-12(15)3-8(14)7-16-13/h3-7H,15H2,1-2H3.
What are the key properties of 5-bromo-2-(3,5-dimethoxyphenoxy)pyridin-3-amine?
5-bromo-2-(3,5-dimethoxyphenoxy)pyridin-3-amine has a molecular weight of 325.16 g/mol, XLogP of 3.24, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-2-(3,5-dimethoxyphenoxy)pyridin-3-amine is sourced from PubChem (CID 61227912), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).