6-[(3-bromophenyl)methoxy]-2-methoxypyridin-3-amine

C13H13BrN2O2 — CID 82827567

IUPAC6-[(3-bromophenyl)methoxy]-2-methoxypyridin-3-amine
SMILESCOc1nc(OCc2cccc(Br)c2)ccc1N
InChIInChI=1S/C13H13BrN2O2/c1-17-13-11(15)5-6-12(16-13)18-8-9-3-2-4-10(14)7-9/h2-7H,8,15H2,1H3
InChIKeyLSBUPOACVUEGKY-UHFFFAOYSA-N
MW309.16 g/mol
LogP3.01
Rot. Bonds4

About 6-[(3-bromophenyl)methoxy]-2-methoxypyridin-3-amine

6-[(3-bromophenyl)methoxy]-2-methoxypyridin-3-amine (PubChem CID 82827567) has the molecular formula C13H13BrN2O2 and a molecular weight of 309.16 g/mol. Its IUPAC name is 6-[(3-bromophenyl)methoxy]-2-methoxypyridin-3-amine.

Molecular Properties

Compound Name6-[(3-bromophenyl)methoxy]-2-methoxypyridin-3-amine
PubChem CID82827567
Molecular FormulaC13H13BrN2O2
Molecular Weight309.16 g/mol
Exact Mass308.02
IUPAC Name6-[(3-bromophenyl)methoxy]-2-methoxypyridin-3-amine
SMILESCOc1nc(OCc2cccc(Br)c2)ccc1N
InChIInChI=1S/C13H13BrN2O2/c1-17-13-11(15)5-6-12(16-13)18-8-9-3-2-4-10(14)7-9/h2-7H,8,15H2,1H3
InChIKeyLSBUPOACVUEGKY-UHFFFAOYSA-N
XLogP3.01
TPSA57.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.16
LogP ≤ 53.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-[(3-bromophenyl)methoxy]-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine
CID 82804375
2-methoxy-6-phenylmethoxypyridin-3-amine
CID 43261924
6-[(3-methoxyphenyl)methoxy]-2-propoxypyridin-3-amine
CID 43262377
methyl 5-amino-6-[(3-bromophenyl)methoxy]pyridine-2-carboxylate
CID 114409176
2-[(3-bromophenyl)methoxy]-5-methylpyridin-4-amine
CID 83270095
3-[(3-bromophenyl)methoxy]-5-methoxyaniline
CID 82828787
[6-[(3-bromophenyl)methoxy]-2-methyl-3-pyridinyl]methanol
CID 82832022
6-[(3-bromophenyl)methoxy]-3-(chloromethyl)-2-methylpyridine
CID 82831791
3-[(3-bromophenyl)methoxy]-2-methylaniline
CID 43437900
6-[(3-bromophenyl)methoxy]pyrimidin-4-amine
CID 82825459
5-bromo-2-[(3-methoxyphenyl)methoxy]pyridin-3-amine
CID 61227713
2-[(3-methoxyphenyl)methoxy]pyridin-3-amine
CID 24708484

Frequently Asked Questions

What is the IUPAC name of 6-[(3-bromophenyl)methoxy]-2-methoxypyridin-3-amine?
The IUPAC name of 6-[(3-bromophenyl)methoxy]-2-methoxypyridin-3-amine (CID 82827567) is 6-[(3-bromophenyl)methoxy]-2-methoxypyridin-3-amine.
What is the SMILES notation for 6-[(3-bromophenyl)methoxy]-2-methoxypyridin-3-amine?
The canonical SMILES for 6-[(3-bromophenyl)methoxy]-2-methoxypyridin-3-amine is COc1nc(OCc2cccc(Br)c2)ccc1N.
What is the InChIKey of 6-[(3-bromophenyl)methoxy]-2-methoxypyridin-3-amine?
The InChIKey is LSBUPOACVUEGKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13BrN2O2/c1-17-13-11(15)5-6-12(16-13)18-8-9-3-2-4-10(14)7-9/h2-7H,8,15H2,1H3.
What are the key properties of 6-[(3-bromophenyl)methoxy]-2-methoxypyridin-3-amine?
6-[(3-bromophenyl)methoxy]-2-methoxypyridin-3-amine has a molecular weight of 309.16 g/mol, XLogP of 3.01, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(3-bromophenyl)methoxy]-2-methoxypyridin-3-amine is sourced from PubChem (CID 82827567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).