[6-(4-bromo-3-methylphenoxy)-2-methyl-3-pyridinyl]methanamine

C14H15BrN2O — CID 83135138

IUPAC[6-(4-bromo-3-methylphenoxy)-2-methyl-3-pyridinyl]methanamine
SMILESCc1cc(Oc2ccc(CN)c(C)n2)ccc1Br
InChIInChI=1S/C14H15BrN2O/c1-9-7-12(4-5-13(9)15)18-14-6-3-11(8-16)10(2)17-14/h3-7H,8,16H2,1-2H3
InChIKeyXCXPMWDLSQJMPX-UHFFFAOYSA-N
MW307.19 g/mol
LogP3.71
Rot. Bonds3

About [6-(4-bromo-3-methylphenoxy)-2-methyl-3-pyridinyl]methanamine

[6-(4-bromo-3-methylphenoxy)-2-methyl-3-pyridinyl]methanamine (PubChem CID 83135138) has the molecular formula C14H15BrN2O and a molecular weight of 307.19 g/mol. Its IUPAC name is [6-(4-bromo-3-methylphenoxy)-2-methyl-3-pyridinyl]methanamine.

Molecular Properties

Compound Name[6-(4-bromo-3-methylphenoxy)-2-methyl-3-pyridinyl]methanamine
PubChem CID83135138
Molecular FormulaC14H15BrN2O
Molecular Weight307.19 g/mol
Exact Mass306.04
IUPAC Name[6-(4-bromo-3-methylphenoxy)-2-methyl-3-pyridinyl]methanamine
SMILESCc1cc(Oc2ccc(CN)c(C)n2)ccc1Br
InChIInChI=1S/C14H15BrN2O/c1-9-7-12(4-5-13(9)15)18-14-6-3-11(8-16)10(2)17-14/h3-7H,8,16H2,1-2H3
InChIKeyXCXPMWDLSQJMPX-UHFFFAOYSA-N
XLogP3.71
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.19
LogP ≤ 53.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze [6-(4-bromo-3-methylphenoxy)-2-methyl-3-pyridinyl]methanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[[6-(4-bromo-3-methylphenoxy)-2-methyl-3-pyridinyl]methyl]cyclopropanamine
CID 83138147
[2-(4-bromo-3-methylphenoxy)-4-pyridinyl]methanamine
CID 83134094
6-(4-bromo-3-methylphenoxy)-2-propan-2-yloxypyridin-3-amine
CID 83133166
4-(4-bromo-3-methylphenoxy)-6-methylpyrimidin-2-amine
CID 83135228
6-(4-bromo-3-methylphenoxy)pyrido[2,3-b]pyrazine
CID 81333354
2-(4-bromo-3-methylphenoxy)-5-methylpyridine
CID 83141020
[5-(4-bromo-3-methylphenoxy)-1,3,4-thiadiazol-2-yl]methanamine
CID 83134197
[6-(1-ethylpyrazol-4-yl)oxy-2-methyl-3-pyridinyl]methanamine
CID 116802826
N-[[6-(4-bromo-3-methylphenoxy)-2-pyridinyl]methyl]cyclopropanamine
CID 83134114
2-(4-bromo-3-methylphenoxy)-5-chloropyridine
CID 83132873
2-(4-bromo-3-methylphenoxy)-4,6-dimethoxypyrimidine
CID 83140189
3-(4-bromo-3-methylphenoxy)-5-methylpyridazine
CID 106549380

Frequently Asked Questions

What is the IUPAC name of [6-(4-bromo-3-methylphenoxy)-2-methyl-3-pyridinyl]methanamine?
The IUPAC name of [6-(4-bromo-3-methylphenoxy)-2-methyl-3-pyridinyl]methanamine (CID 83135138) is [6-(4-bromo-3-methylphenoxy)-2-methyl-3-pyridinyl]methanamine.
What is the SMILES notation for [6-(4-bromo-3-methylphenoxy)-2-methyl-3-pyridinyl]methanamine?
The canonical SMILES for [6-(4-bromo-3-methylphenoxy)-2-methyl-3-pyridinyl]methanamine is Cc1cc(Oc2ccc(CN)c(C)n2)ccc1Br.
What is the InChIKey of [6-(4-bromo-3-methylphenoxy)-2-methyl-3-pyridinyl]methanamine?
The InChIKey is XCXPMWDLSQJMPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15BrN2O/c1-9-7-12(4-5-13(9)15)18-14-6-3-11(8-16)10(2)17-14/h3-7H,8,16H2,1-2H3.
What are the key properties of [6-(4-bromo-3-methylphenoxy)-2-methyl-3-pyridinyl]methanamine?
[6-(4-bromo-3-methylphenoxy)-2-methyl-3-pyridinyl]methanamine has a molecular weight of 307.19 g/mol, XLogP of 3.71, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(4-bromo-3-methylphenoxy)-2-methyl-3-pyridinyl]methanamine is sourced from PubChem (CID 83135138), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).