6-(3-bromophenoxy)-N-ethylpyridin-2-amine

C13H13BrN2O — CID 80869088

IUPAC6-(3-bromophenoxy)-N-ethylpyridin-2-amine
SMILESCCNc1cccc(Oc2cccc(Br)c2)n1
InChIInChI=1S/C13H13BrN2O/c1-2-15-12-7-4-8-13(16-12)17-11-6-3-5-10(14)9-11/h3-9H,2H2,1H3,(H,15,16)
InChIKeyUIGRGAGSGJKDBI-UHFFFAOYSA-N
MW293.16 g/mol
LogP4.07
Rot. Bonds4

About 6-(3-bromophenoxy)-N-ethylpyridin-2-amine

6-(3-bromophenoxy)-N-ethylpyridin-2-amine (PubChem CID 80869088) has the molecular formula C13H13BrN2O and a molecular weight of 293.16 g/mol. Its IUPAC name is 6-(3-bromophenoxy)-N-ethylpyridin-2-amine.

Molecular Properties

Compound Name6-(3-bromophenoxy)-N-ethylpyridin-2-amine
PubChem CID80869088
Molecular FormulaC13H13BrN2O
Molecular Weight293.16 g/mol
Exact Mass292.02
IUPAC Name6-(3-bromophenoxy)-N-ethylpyridin-2-amine
SMILESCCNc1cccc(Oc2cccc(Br)c2)n1
InChIInChI=1S/C13H13BrN2O/c1-2-15-12-7-4-8-13(16-12)17-11-6-3-5-10(14)9-11/h3-9H,2H2,1H3,(H,15,16)
InChIKeyUIGRGAGSGJKDBI-UHFFFAOYSA-N
XLogP4.07
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.16
LogP ≤ 54.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-(6-bromonaphthalen-2-yl)oxy-N-ethylpyridin-2-amine
CID 80865759
6-(3-ethoxyphenoxy)-N-ethylpyridin-2-amine
CID 80873339
6-(3-bromophenoxy)-2-tert-butyl-N-ethylpyrimidin-4-amine
CID 80966382
6-(4-bromo-3,5-dimethylphenoxy)-N-ethylpyridin-2-amine
CID 107727278
N-ethyl-6-(3-propan-2-ylphenoxy)pyridin-2-amine
CID 80864399
6-(3,4-dichlorophenoxy)-N-ethylpyridin-2-amine
CID 80874477
6-(4-bromo-2-fluorophenoxy)-N-ethylpyridin-2-amine
CID 80881020
6-(3-bromophenoxy)-2-cyclopropyl-N-ethylpyrimidin-4-amine
CID 80965597
N-ethyl-6-(5,6,7,8-tetrahydronaphthalen-2-yloxy)pyridin-2-amine
CID 80872364
2-bromo-6-(3-bromophenoxy)pyridine
CID 63962984
6-(3-bromo-5-fluorophenoxy)-N-propylpyridin-2-amine
CID 81325494
6-(3-methylphenoxy)-N-propylpyridin-2-amine
CID 80869779

Frequently Asked Questions

What is the IUPAC name of 6-(3-bromophenoxy)-N-ethylpyridin-2-amine?
The IUPAC name of 6-(3-bromophenoxy)-N-ethylpyridin-2-amine (CID 80869088) is 6-(3-bromophenoxy)-N-ethylpyridin-2-amine.
What is the SMILES notation for 6-(3-bromophenoxy)-N-ethylpyridin-2-amine?
The canonical SMILES for 6-(3-bromophenoxy)-N-ethylpyridin-2-amine is CCNc1cccc(Oc2cccc(Br)c2)n1.
What is the InChIKey of 6-(3-bromophenoxy)-N-ethylpyridin-2-amine?
The InChIKey is UIGRGAGSGJKDBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13BrN2O/c1-2-15-12-7-4-8-13(16-12)17-11-6-3-5-10(14)9-11/h3-9H,2H2,1H3,(H,15,16).
What are the key properties of 6-(3-bromophenoxy)-N-ethylpyridin-2-amine?
6-(3-bromophenoxy)-N-ethylpyridin-2-amine has a molecular weight of 293.16 g/mol, XLogP of 4.07, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3-bromophenoxy)-N-ethylpyridin-2-amine is sourced from PubChem (CID 80869088), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).