5-bromo-6-(3-ethoxyphenoxy)-4-methylpyridin-3-amine

C14H15BrN2O2 — CID 104507343

IUPAC5-bromo-6-(3-ethoxyphenoxy)-4-methylpyridin-3-amine
SMILESCCOc1cccc(Oc2ncc(N)c(C)c2Br)c1
InChIInChI=1S/C14H15BrN2O2/c1-3-18-10-5-4-6-11(7-10)19-14-13(15)9(2)12(16)8-17-14/h4-8H,3,16H2,1-2H3
InChIKeyBAUBFCHIFZSMSO-UHFFFAOYSA-N
MW323.19 g/mol
LogP3.93
Rot. Bonds4

About 5-bromo-6-(3-ethoxyphenoxy)-4-methylpyridin-3-amine

5-bromo-6-(3-ethoxyphenoxy)-4-methylpyridin-3-amine (PubChem CID 104507343) has the molecular formula C14H15BrN2O2 and a molecular weight of 323.19 g/mol. Its IUPAC name is 5-bromo-6-(3-ethoxyphenoxy)-4-methylpyridin-3-amine.

Molecular Properties

Compound Name5-bromo-6-(3-ethoxyphenoxy)-4-methylpyridin-3-amine
PubChem CID104507343
Molecular FormulaC14H15BrN2O2
Molecular Weight323.19 g/mol
Exact Mass322.03
IUPAC Name5-bromo-6-(3-ethoxyphenoxy)-4-methylpyridin-3-amine
SMILESCCOc1cccc(Oc2ncc(N)c(C)c2Br)c1
InChIInChI=1S/C14H15BrN2O2/c1-3-18-10-5-4-6-11(7-10)19-14-13(15)9(2)12(16)8-17-14/h4-8H,3,16H2,1-2H3
InChIKeyBAUBFCHIFZSMSO-UHFFFAOYSA-N
XLogP3.93
TPSA57.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.19
LogP ≤ 53.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-bromo-6-(3-iodophenoxy)-4-methylpyridin-3-amine
CID 104507301
3-[(5-amino-3-bromo-4-methyl-2-pyridinyl)oxy]benzonitrile
CID 104507270
3-bromo-2-(3-ethoxyphenoxy)-4-methylpyridine
CID 106877996
5-bromo-6-(4-chloro-3-fluorophenoxy)-4-methylpyridin-3-amine
CID 113420590
5-bromo-6-(2,3-dihydro-1H-inden-5-yloxy)-4-methylpyridin-3-amine
CID 104507282
6-(1,3-benzodioxol-5-yloxy)-5-bromo-4-methylpyridin-3-amine
CID 104507278
3-(3-ethoxyphenoxy)pyrazin-2-amine
CID 102988136
2-(3-ethoxyphenoxy)pyrimidin-5-amine
CID 55060800
5-bromo-3-(chloromethyl)-2-(3-ethoxyphenoxy)pyridine
CID 55060803
4-[(5-amino-3-bromo-4-methyl-2-pyridinyl)oxy]benzamide
CID 104507271
5-bromo-6-[(2-ethyl-6-methyl-3-pyridinyl)oxy]-4-methylpyridin-3-amine
CID 103174438
3-(3-ethoxyphenoxy)quinoxalin-2-amine
CID 102988134

Frequently Asked Questions

What is the IUPAC name of 5-bromo-6-(3-ethoxyphenoxy)-4-methylpyridin-3-amine?
The IUPAC name of 5-bromo-6-(3-ethoxyphenoxy)-4-methylpyridin-3-amine (CID 104507343) is 5-bromo-6-(3-ethoxyphenoxy)-4-methylpyridin-3-amine.
What is the SMILES notation for 5-bromo-6-(3-ethoxyphenoxy)-4-methylpyridin-3-amine?
The canonical SMILES for 5-bromo-6-(3-ethoxyphenoxy)-4-methylpyridin-3-amine is CCOc1cccc(Oc2ncc(N)c(C)c2Br)c1.
What is the InChIKey of 5-bromo-6-(3-ethoxyphenoxy)-4-methylpyridin-3-amine?
The InChIKey is BAUBFCHIFZSMSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15BrN2O2/c1-3-18-10-5-4-6-11(7-10)19-14-13(15)9(2)12(16)8-17-14/h4-8H,3,16H2,1-2H3.
What are the key properties of 5-bromo-6-(3-ethoxyphenoxy)-4-methylpyridin-3-amine?
5-bromo-6-(3-ethoxyphenoxy)-4-methylpyridin-3-amine has a molecular weight of 323.19 g/mol, XLogP of 3.93, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-6-(3-ethoxyphenoxy)-4-methylpyridin-3-amine is sourced from PubChem (CID 104507343), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).