6-(2-bromophenoxy)-5-methylpyridin-3-amine

C12H11BrN2O — CID 62476241

IUPAC6-(2-bromophenoxy)-5-methylpyridin-3-amine
SMILESCc1cc(N)cnc1Oc1ccccc1Br
InChIInChI=1S/C12H11BrN2O/c1-8-6-9(14)7-15-12(8)16-11-5-3-2-4-10(11)13/h2-7H,14H2,1H3
InChIKeyLPNCEVDPCWXKJF-UHFFFAOYSA-N
MW279.14 g/mol
LogP3.53
Rot. Bonds2

About 6-(2-bromophenoxy)-5-methylpyridin-3-amine

6-(2-bromophenoxy)-5-methylpyridin-3-amine (PubChem CID 62476241) has the molecular formula C12H11BrN2O and a molecular weight of 279.14 g/mol. Its IUPAC name is 6-(2-bromophenoxy)-5-methylpyridin-3-amine.

Molecular Properties

Compound Name6-(2-bromophenoxy)-5-methylpyridin-3-amine
PubChem CID62476241
Molecular FormulaC12H11BrN2O
Molecular Weight279.14 g/mol
Exact Mass278.01
IUPAC Name6-(2-bromophenoxy)-5-methylpyridin-3-amine
SMILESCc1cc(N)cnc1Oc1ccccc1Br
InChIInChI=1S/C12H11BrN2O/c1-8-6-9(14)7-15-12(8)16-11-5-3-2-4-10(11)13/h2-7H,14H2,1H3
InChIKeyLPNCEVDPCWXKJF-UHFFFAOYSA-N
XLogP3.53
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.14
LogP ≤ 53.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-(2-bromophenoxy)-5-methylpyridin-3-amine?
The IUPAC name of 6-(2-bromophenoxy)-5-methylpyridin-3-amine (CID 62476241) is 6-(2-bromophenoxy)-5-methylpyridin-3-amine.
What is the SMILES notation for 6-(2-bromophenoxy)-5-methylpyridin-3-amine?
The canonical SMILES for 6-(2-bromophenoxy)-5-methylpyridin-3-amine is Cc1cc(N)cnc1Oc1ccccc1Br.
What is the InChIKey of 6-(2-bromophenoxy)-5-methylpyridin-3-amine?
The InChIKey is LPNCEVDPCWXKJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11BrN2O/c1-8-6-9(14)7-15-12(8)16-11-5-3-2-4-10(11)13/h2-7H,14H2,1H3.
What are the key properties of 6-(2-bromophenoxy)-5-methylpyridin-3-amine?
6-(2-bromophenoxy)-5-methylpyridin-3-amine has a molecular weight of 279.14 g/mol, XLogP of 3.53, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-bromophenoxy)-5-methylpyridin-3-amine is sourced from PubChem (CID 62476241), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).