5-bromo-4-(4-bromo-2-propan-2-ylphenoxy)pyridin-3-amine

C14H14Br2N2O — CID 103518830

IUPAC5-bromo-4-(4-bromo-2-propan-2-ylphenoxy)pyridin-3-amine
SMILESCC(C)c1cc(Br)ccc1Oc1c(N)cncc1Br
InChIInChI=1S/C14H14Br2N2O/c1-8(2)10-5-9(15)3-4-13(10)19-14-11(16)6-18-7-12(14)17/h3-8H,17H2,1-2H3
InChIKeyOSGZGZPKXCFBQX-UHFFFAOYSA-N
MW386.09 g/mol
LogP5.10
Rot. Bonds3

About 5-bromo-4-(4-bromo-2-propan-2-ylphenoxy)pyridin-3-amine

5-bromo-4-(4-bromo-2-propan-2-ylphenoxy)pyridin-3-amine (PubChem CID 103518830) has the molecular formula C14H14Br2N2O and a molecular weight of 386.09 g/mol. Its IUPAC name is 5-bromo-4-(4-bromo-2-propan-2-ylphenoxy)pyridin-3-amine.

Molecular Properties

Compound Name5-bromo-4-(4-bromo-2-propan-2-ylphenoxy)pyridin-3-amine
PubChem CID103518830
Molecular FormulaC14H14Br2N2O
Molecular Weight386.09 g/mol
Exact Mass383.95
IUPAC Name5-bromo-4-(4-bromo-2-propan-2-ylphenoxy)pyridin-3-amine
SMILESCC(C)c1cc(Br)ccc1Oc1c(N)cncc1Br
InChIInChI=1S/C14H14Br2N2O/c1-8(2)10-5-9(15)3-4-13(10)19-14-11(16)6-18-7-12(14)17/h3-8H,17H2,1-2H3
InChIKeyOSGZGZPKXCFBQX-UHFFFAOYSA-N
XLogP5.10
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500386.09
LogP ≤ 55.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-(4-bromo-2-propan-2-ylphenoxy)pyrazin-2-amine
CID 113303072
5-bromo-4-(6-bromonaphthalen-2-yl)oxypyridin-3-amine
CID 103518685
2-(4-bromo-2-propan-2-ylphenoxy)-4,5-dichloroaniline
CID 115401583
6-(4-bromo-2-propan-2-ylphenoxy)-2-methoxypyridin-3-amine
CID 115401558
6-(4-bromo-2-propan-2-ylphenoxy)-N-methylpyrazin-2-amine
CID 115403123
3-bromo-2-(4-bromo-2-propan-2-ylphenoxy)pyridine
CID 115402194
4-(4-bromo-2-propan-2-ylphenoxy)pyrimidin-2-amine
CID 113303074
1-[5-(4-bromo-2-propan-2-ylphenoxy)-2-pyridinyl]ethanamine
CID 83123632
(4-bromo-2-propan-2-ylphenoxy)-trimethylsilane
CID 167738069
2-bromo-6-(4-bromo-2-propan-2-ylphenoxy)pyridine
CID 113302880
5-bromo-4-naphthalen-1-yloxypyridin-3-amine
CID 103518682
1-[4-(4-bromo-2-propan-2-ylphenoxy)phenyl]ethanamine
CID 115402372

Frequently Asked Questions

What is the IUPAC name of 5-bromo-4-(4-bromo-2-propan-2-ylphenoxy)pyridin-3-amine?
The IUPAC name of 5-bromo-4-(4-bromo-2-propan-2-ylphenoxy)pyridin-3-amine (CID 103518830) is 5-bromo-4-(4-bromo-2-propan-2-ylphenoxy)pyridin-3-amine.
What is the SMILES notation for 5-bromo-4-(4-bromo-2-propan-2-ylphenoxy)pyridin-3-amine?
The canonical SMILES for 5-bromo-4-(4-bromo-2-propan-2-ylphenoxy)pyridin-3-amine is CC(C)c1cc(Br)ccc1Oc1c(N)cncc1Br.
What is the InChIKey of 5-bromo-4-(4-bromo-2-propan-2-ylphenoxy)pyridin-3-amine?
The InChIKey is OSGZGZPKXCFBQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14Br2N2O/c1-8(2)10-5-9(15)3-4-13(10)19-14-11(16)6-18-7-12(14)17/h3-8H,17H2,1-2H3.
What are the key properties of 5-bromo-4-(4-bromo-2-propan-2-ylphenoxy)pyridin-3-amine?
5-bromo-4-(4-bromo-2-propan-2-ylphenoxy)pyridin-3-amine has a molecular weight of 386.09 g/mol, XLogP of 5.10, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-4-(4-bromo-2-propan-2-ylphenoxy)pyridin-3-amine is sourced from PubChem (CID 103518830), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).