2-[(5-bromo-3-pyridinyl)oxymethyl]-6-methylpyridine

C12H11BrN2O — CID 79267890

IUPAC2-[(5-bromo-3-pyridinyl)oxymethyl]-6-methylpyridine
SMILESCc1cccc(COc2cncc(Br)c2)n1
InChIInChI=1S/C12H11BrN2O/c1-9-3-2-4-11(15-9)8-16-12-5-10(13)6-14-7-12/h2-7H,8H2,1H3
InChIKeyBDZBABSEXMOKSK-UHFFFAOYSA-N
MW279.14 g/mol
LogP3.13
Rot. Bonds3

About 2-[(5-bromo-3-pyridinyl)oxymethyl]-6-methylpyridine

2-[(5-bromo-3-pyridinyl)oxymethyl]-6-methylpyridine (PubChem CID 79267890) has the molecular formula C12H11BrN2O and a molecular weight of 279.14 g/mol. Its IUPAC name is 2-[(5-bromo-3-pyridinyl)oxymethyl]-6-methylpyridine.

Molecular Properties

Compound Name2-[(5-bromo-3-pyridinyl)oxymethyl]-6-methylpyridine
PubChem CID79267890
Molecular FormulaC12H11BrN2O
Molecular Weight279.14 g/mol
Exact Mass278.01
IUPAC Name2-[(5-bromo-3-pyridinyl)oxymethyl]-6-methylpyridine
SMILESCc1cccc(COc2cncc(Br)c2)n1
InChIInChI=1S/C12H11BrN2O/c1-9-3-2-4-11(15-9)8-16-12-5-10(13)6-14-7-12/h2-7H,8H2,1H3
InChIKeyBDZBABSEXMOKSK-UHFFFAOYSA-N
XLogP3.13
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.14
LogP ≤ 53.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 2-[(5-bromo-3-pyridinyl)oxymethyl]-6-methylpyridine 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

6-[(5-bromo-3-pyridinyl)oxymethyl]-N-methylpyridin-2-amine
CID 79239382
N-[[6-[(5-bromo-3-pyridinyl)oxymethyl]-2-pyridinyl]methyl]propan-2-amine
CID 106908394
N-[[6-[(5-bromo-3-pyridinyl)oxymethyl]-2-pyridinyl]methyl]cyclopropanamine
CID 106908393
2-methyl-4-[(6-methyl-2-pyridinyl)methoxy]aniline
CID 79267749
3-bromo-5-phenylmethoxypyridine
CID 15389198
2-(chloromethyl)-5-[(6-methyl-2-pyridinyl)methoxy]pyridine
CID 79799554
[4-[(6-methyl-2-pyridinyl)methoxy]phenyl]methanol
CID 79267363
3-bromo-5-[(1-methyltriazol-4-yl)methoxy]pyridine
CID 107043116
3-bromo-5-[(5-methyl-1H-1,2,4-triazol-3-yl)methoxy]pyridine
CID 130603980
2-[(5-bromo-3-pyridinyl)oxymethyl]-N-ethylpyridin-4-amine
CID 79259695
[2-[(5-bromo-3-pyridinyl)oxymethyl]-3-pyridinyl]methanamine
CID 114199251
N-methyl-1-[3-[(6-methyl-2-pyridinyl)methoxy]phenyl]methanamine
CID 79268111

Frequently Asked Questions

What is the IUPAC name of 2-[(5-bromo-3-pyridinyl)oxymethyl]-6-methylpyridine?
The IUPAC name of 2-[(5-bromo-3-pyridinyl)oxymethyl]-6-methylpyridine (CID 79267890) is 2-[(5-bromo-3-pyridinyl)oxymethyl]-6-methylpyridine.
What is the SMILES notation for 2-[(5-bromo-3-pyridinyl)oxymethyl]-6-methylpyridine?
The canonical SMILES for 2-[(5-bromo-3-pyridinyl)oxymethyl]-6-methylpyridine is Cc1cccc(COc2cncc(Br)c2)n1.
What is the InChIKey of 2-[(5-bromo-3-pyridinyl)oxymethyl]-6-methylpyridine?
The InChIKey is BDZBABSEXMOKSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11BrN2O/c1-9-3-2-4-11(15-9)8-16-12-5-10(13)6-14-7-12/h2-7H,8H2,1H3.
What are the key properties of 2-[(5-bromo-3-pyridinyl)oxymethyl]-6-methylpyridine?
2-[(5-bromo-3-pyridinyl)oxymethyl]-6-methylpyridine has a molecular weight of 279.14 g/mol, XLogP of 3.13, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(5-bromo-3-pyridinyl)oxymethyl]-6-methylpyridine is sourced from PubChem (CID 79267890), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).