(5-bromo-6-methoxy-4-methyl-2-pyridinyl)methanamine

C8H11BrN2O — CID 178084795

IUPAC(5-bromo-6-methoxy-4-methyl-2-pyridinyl)methanamine
SMILESCOc1nc(CN)cc(C)c1Br
InChIInChI=1S/C8H11BrN2O/c1-5-3-6(4-10)11-8(12-2)7(5)9/h3H,4,10H2,1-2H3
InChIKeyKINRSPHTWAMKII-UHFFFAOYSA-N
MW231.09 g/mol
LogP1.62
Rot. Bonds2

About (5-bromo-6-methoxy-4-methyl-2-pyridinyl)methanamine

(5-bromo-6-methoxy-4-methyl-2-pyridinyl)methanamine (PubChem CID 178084795) has the molecular formula C8H11BrN2O and a molecular weight of 231.09 g/mol. Its IUPAC name is (5-bromo-6-methoxy-4-methyl-2-pyridinyl)methanamine.

Molecular Properties

Compound Name(5-bromo-6-methoxy-4-methyl-2-pyridinyl)methanamine
PubChem CID178084795
Molecular FormulaC8H11BrN2O
Molecular Weight231.09 g/mol
Exact Mass230.01
IUPAC Name(5-bromo-6-methoxy-4-methyl-2-pyridinyl)methanamine
SMILESCOc1nc(CN)cc(C)c1Br
InChIInChI=1S/C8H11BrN2O/c1-5-3-6(4-10)11-8(12-2)7(5)9/h3H,4,10H2,1-2H3
InChIKeyKINRSPHTWAMKII-UHFFFAOYSA-N
XLogP1.62
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.09
LogP ≤ 51.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(5-bromo-6-methoxy-4-methyl-2-pyridinyl)acetamide
CID 178084455
(2-bromo-6-methoxypyrimidin-4-yl)methanamine
CID 83852368
[4-(difluoromethyl)-5-fluoro-6-methoxy-2-pyridinyl]methanamine
CID 130080557
[5-(difluoromethyl)-4-fluoro-6-methoxy-2-pyridinyl]methanamine
CID 130080559
(2,6-dimethoxy-4-methyl-3-pyridinyl)methanamine
CID 84658523
2-(6-methoxy-5-methyl-2-pyridinyl)ethanamine
CID 84652437
6-(bromomethyl)-3-(difluoromethyl)-2-methoxy-4-methylpyridine
CID 130087803
(2-bromo-7-methyl-1H-imidazo[4,5-b]pyridin-5-yl)methanamine
CID 130048332
(2-bromo-5,6-dimethoxy-3-methylphenyl)methanamine
CID 84710081
6-(aminomethyl)-2-methoxypyridin-3-ol
CID 126970896
(6-bromo-4-methylquinolin-2-yl)methanamine
CID 83527571
(6-methoxy-5-methyl-3-pyridinyl)methanamine
CID 59238572

Frequently Asked Questions

What is the IUPAC name of (5-bromo-6-methoxy-4-methyl-2-pyridinyl)methanamine?
The IUPAC name of (5-bromo-6-methoxy-4-methyl-2-pyridinyl)methanamine (CID 178084795) is (5-bromo-6-methoxy-4-methyl-2-pyridinyl)methanamine.
What is the SMILES notation for (5-bromo-6-methoxy-4-methyl-2-pyridinyl)methanamine?
The canonical SMILES for (5-bromo-6-methoxy-4-methyl-2-pyridinyl)methanamine is COc1nc(CN)cc(C)c1Br.
What is the InChIKey of (5-bromo-6-methoxy-4-methyl-2-pyridinyl)methanamine?
The InChIKey is KINRSPHTWAMKII-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11BrN2O/c1-5-3-6(4-10)11-8(12-2)7(5)9/h3H,4,10H2,1-2H3.
What are the key properties of (5-bromo-6-methoxy-4-methyl-2-pyridinyl)methanamine?
(5-bromo-6-methoxy-4-methyl-2-pyridinyl)methanamine has a molecular weight of 231.09 g/mol, XLogP of 1.62, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5-bromo-6-methoxy-4-methyl-2-pyridinyl)methanamine is sourced from PubChem (CID 178084795), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).