2-(bromomethyl)-5-[(2-methoxyphenyl)methoxy]pyridine

C14H14BrNO2 — CID 79799388

IUPAC2-(bromomethyl)-5-[(2-methoxyphenyl)methoxy]pyridine
SMILESCOc1ccccc1COc1ccc(CBr)nc1
InChIInChI=1S/C14H14BrNO2/c1-17-14-5-3-2-4-11(14)10-18-13-7-6-12(8-15)16-9-13/h2-7,9H,8,10H2,1H3
InChIKeyBWMFGPNWUYJHMA-UHFFFAOYSA-N
MW308.18 g/mol
LogP3.56
Rot. Bonds5

About 2-(bromomethyl)-5-[(2-methoxyphenyl)methoxy]pyridine

2-(bromomethyl)-5-[(2-methoxyphenyl)methoxy]pyridine (PubChem CID 79799388) has the molecular formula C14H14BrNO2 and a molecular weight of 308.18 g/mol. Its IUPAC name is 2-(bromomethyl)-5-[(2-methoxyphenyl)methoxy]pyridine.

Molecular Properties

Compound Name2-(bromomethyl)-5-[(2-methoxyphenyl)methoxy]pyridine
PubChem CID79799388
Molecular FormulaC14H14BrNO2
Molecular Weight308.18 g/mol
Exact Mass307.02
IUPAC Name2-(bromomethyl)-5-[(2-methoxyphenyl)methoxy]pyridine
SMILESCOc1ccccc1COc1ccc(CBr)nc1
InChIInChI=1S/C14H14BrNO2/c1-17-14-5-3-2-4-11(14)10-18-13-7-6-12(8-15)16-9-13/h2-7,9H,8,10H2,1H3
InChIKeyBWMFGPNWUYJHMA-UHFFFAOYSA-N
XLogP3.56
TPSA31.35 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.18
LogP ≤ 53.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}

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Related Compounds

1-bromo-4-[(2-methoxyphenyl)methoxy]benzene
CID 54940328
[4-[(2-methoxyphenyl)methoxy]phenyl]methanol
CID 54940415
4-[(2-methoxyphenyl)methoxy]-1-methylpyrazole
CID 116794197
2-(bromomethyl)-5-[(4-methoxy-3-nitrophenyl)methoxy]pyridine
CID 79790004
trifluoro-[4-[(2-methoxyphenyl)methoxy]phenyl]boranuide
CID 63677704
4-[(2-methoxyphenyl)methoxy]benzaldehyde
CID 4129498
2-(bromomethyl)-5-[(3-chloro-4-pyridinyl)methoxy]pyridine
CID 79799954
2-(bromomethyl)-5-(pyridin-4-ylmethoxy)pyridine
CID 79799847
2-(bromomethyl)-5-[(5-fluoro-2-nitrophenyl)methoxy]pyridine
CID 79800306
2-(bromomethyl)-5-[(5-ethylthiophen-2-yl)methoxy]pyridine
CID 79800580
(1S)-1-[4-[(2-methoxyphenyl)methoxy]phenyl]ethanol
CID 78930283
N-[[5-[(5-bromo-2-methoxyphenyl)methoxy]-2-pyridinyl]methyl]ethanamine
CID 79782055

Frequently Asked Questions

What is the IUPAC name of 2-(bromomethyl)-5-[(2-methoxyphenyl)methoxy]pyridine?
The IUPAC name of 2-(bromomethyl)-5-[(2-methoxyphenyl)methoxy]pyridine (CID 79799388) is 2-(bromomethyl)-5-[(2-methoxyphenyl)methoxy]pyridine.
What is the SMILES notation for 2-(bromomethyl)-5-[(2-methoxyphenyl)methoxy]pyridine?
The canonical SMILES for 2-(bromomethyl)-5-[(2-methoxyphenyl)methoxy]pyridine is COc1ccccc1COc1ccc(CBr)nc1.
What is the InChIKey of 2-(bromomethyl)-5-[(2-methoxyphenyl)methoxy]pyridine?
The InChIKey is BWMFGPNWUYJHMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14BrNO2/c1-17-14-5-3-2-4-11(14)10-18-13-7-6-12(8-15)16-9-13/h2-7,9H,8,10H2,1H3.
What are the key properties of 2-(bromomethyl)-5-[(2-methoxyphenyl)methoxy]pyridine?
2-(bromomethyl)-5-[(2-methoxyphenyl)methoxy]pyridine has a molecular weight of 308.18 g/mol, XLogP of 3.56, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(bromomethyl)-5-[(2-methoxyphenyl)methoxy]pyridine is sourced from PubChem (CID 79799388), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).