6-(2-bromo-4-methoxyphenoxy)pyridin-3-amine

C12H11BrN2O2 — CID 104706426

IUPAC6-(2-bromo-4-methoxyphenoxy)pyridin-3-amine
SMILESCOc1ccc(Oc2ccc(N)cn2)c(Br)c1
InChIInChI=1S/C12H11BrN2O2/c1-16-9-3-4-11(10(13)6-9)17-12-5-2-8(14)7-15-12/h2-7H,14H2,1H3
InChIKeyQRXFVYWDHOGWKA-UHFFFAOYSA-N
MW295.14 g/mol
LogP3.23
Rot. Bonds3

About 6-(2-bromo-4-methoxyphenoxy)pyridin-3-amine

6-(2-bromo-4-methoxyphenoxy)pyridin-3-amine (PubChem CID 104706426) has the molecular formula C12H11BrN2O2 and a molecular weight of 295.14 g/mol. Its IUPAC name is 6-(2-bromo-4-methoxyphenoxy)pyridin-3-amine.

Molecular Properties

Compound Name6-(2-bromo-4-methoxyphenoxy)pyridin-3-amine
PubChem CID104706426
Molecular FormulaC12H11BrN2O2
Molecular Weight295.14 g/mol
Exact Mass294.00
IUPAC Name6-(2-bromo-4-methoxyphenoxy)pyridin-3-amine
SMILESCOc1ccc(Oc2ccc(N)cn2)c(Br)c1
InChIInChI=1S/C12H11BrN2O2/c1-16-9-3-4-11(10(13)6-9)17-12-5-2-8(14)7-15-12/h2-7H,14H2,1H3
InChIKeyQRXFVYWDHOGWKA-UHFFFAOYSA-N
XLogP3.23
TPSA57.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.14
LogP ≤ 53.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_OC_no_alk_A(8)', 'substructure': 'N/A'}

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Related Compounds

5-(2-bromo-4-methoxyphenoxy)pyrazin-2-amine
CID 104708756
1-[6-(2-bromo-4-methoxyphenoxy)-3-pyridinyl]ethanone
CID 113443679
6-(3,5-dimethoxyphenoxy)pyridin-3-amine
CID 43589800
6-(3-methoxyphenoxy)pyridin-3-amine
CID 806744
4-[(5-methoxy-2-pyridinyl)oxy]-3-methylaniline
CID 106504339
6-(5-bromo-2-methylphenoxy)pyridin-3-amine
CID 107283348
5-(2-bromo-4-methoxyphenoxy)pyrazine-2-carbonitrile
CID 104707141
6-[4-[(5-amino-2-pyridinyl)oxy]phenoxy]pyridin-3-amine
CID 102449756
4-(2-bromo-4-methoxyphenoxy)-3-iodoaniline
CID 113443529
4-(2-bromo-4-methoxyphenoxy)pyrimidin-5-amine
CID 104706575
2-[(5-chloro-2-pyridinyl)oxy]-5-methoxyaniline
CID 43173743
[6-(2-bromo-4-methoxyphenoxy)pyridazin-3-yl]methanamine
CID 104708330

Frequently Asked Questions

What is the IUPAC name of 6-(2-bromo-4-methoxyphenoxy)pyridin-3-amine?
The IUPAC name of 6-(2-bromo-4-methoxyphenoxy)pyridin-3-amine (CID 104706426) is 6-(2-bromo-4-methoxyphenoxy)pyridin-3-amine.
What is the SMILES notation for 6-(2-bromo-4-methoxyphenoxy)pyridin-3-amine?
The canonical SMILES for 6-(2-bromo-4-methoxyphenoxy)pyridin-3-amine is COc1ccc(Oc2ccc(N)cn2)c(Br)c1.
What is the InChIKey of 6-(2-bromo-4-methoxyphenoxy)pyridin-3-amine?
The InChIKey is QRXFVYWDHOGWKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11BrN2O2/c1-16-9-3-4-11(10(13)6-9)17-12-5-2-8(14)7-15-12/h2-7H,14H2,1H3.
What are the key properties of 6-(2-bromo-4-methoxyphenoxy)pyridin-3-amine?
6-(2-bromo-4-methoxyphenoxy)pyridin-3-amine has a molecular weight of 295.14 g/mol, XLogP of 3.23, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-bromo-4-methoxyphenoxy)pyridin-3-amine is sourced from PubChem (CID 104706426), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).