2-(bromomethyl)-5-[(5-bromothiophen-2-yl)methoxy]pyridine

C11H9Br2NOS — CID 79800755

IUPAC2-(bromomethyl)-5-[(5-bromothiophen-2-yl)methoxy]pyridine
SMILESBrCc1ccc(OCc2ccc(Br)s2)cn1
InChIInChI=1S/C11H9Br2NOS/c12-5-8-1-2-9(6-14-8)15-7-10-3-4-11(13)16-10/h1-4,6H,5,7H2
InChIKeyGRXBPPTZVSIVBZ-UHFFFAOYSA-N
MW363.07 g/mol
LogP4.38
Rot. Bonds4

About 2-(bromomethyl)-5-[(5-bromothiophen-2-yl)methoxy]pyridine

2-(bromomethyl)-5-[(5-bromothiophen-2-yl)methoxy]pyridine (PubChem CID 79800755) has the molecular formula C11H9Br2NOS and a molecular weight of 363.07 g/mol. Its IUPAC name is 2-(bromomethyl)-5-[(5-bromothiophen-2-yl)methoxy]pyridine.

Molecular Properties

Compound Name2-(bromomethyl)-5-[(5-bromothiophen-2-yl)methoxy]pyridine
PubChem CID79800755
Molecular FormulaC11H9Br2NOS
Molecular Weight363.07 g/mol
Exact Mass360.88
IUPAC Name2-(bromomethyl)-5-[(5-bromothiophen-2-yl)methoxy]pyridine
SMILESBrCc1ccc(OCc2ccc(Br)s2)cn1
InChIInChI=1S/C11H9Br2NOS/c12-5-8-1-2-9(6-14-8)15-7-10-3-4-11(13)16-10/h1-4,6H,5,7H2
InChIKeyGRXBPPTZVSIVBZ-UHFFFAOYSA-N
XLogP4.38
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.07
LogP ≤ 54.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 2-(bromomethyl)-5-[(5-bromothiophen-2-yl)methoxy]pyridine 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

2-(bromomethyl)-5-[(5-ethylthiophen-2-yl)methoxy]pyridine
CID 79800580
5-[(5-bromothiophen-2-yl)methoxy]-2-fluoropyridine
CID 115371625
5-[(5-bromothiophen-2-yl)methoxy]pyridine-2-carboxylic acid
CID 79794866
3-[5-[(5-bromothiophen-2-yl)methoxy]-2-pyridinyl]prop-2-enoic acid
CID 79799402
2-(bromomethyl)-5-(pyridin-4-ylmethoxy)pyridine
CID 79799847
2-bromo-5-(naphthalen-2-yloxymethyl)thiophene
CID 63458037
2-[[6-(bromomethyl)-3-pyridinyl]oxymethyl]-1,3-benzothiazole
CID 104631389
2-[5-[(5-ethylthiophen-2-yl)methoxy]-2-pyridinyl]ethanamine
CID 79800152
5-[(4-bromo-1-ethyl-3-methylpyrazol-5-yl)methoxy]-2-(bromomethyl)pyridine
CID 79799948
2-(bromomethyl)-5-[(3-chloro-4-pyridinyl)methoxy]pyridine
CID 79799954
2-(bromomethyl)-5-[(2-methoxyphenyl)methoxy]pyridine
CID 79799388
(1R)-1-[4-[(5-bromothiophen-2-yl)methoxy]phenyl]propan-1-amine
CID 78937135

Frequently Asked Questions

What is the IUPAC name of 2-(bromomethyl)-5-[(5-bromothiophen-2-yl)methoxy]pyridine?
The IUPAC name of 2-(bromomethyl)-5-[(5-bromothiophen-2-yl)methoxy]pyridine (CID 79800755) is 2-(bromomethyl)-5-[(5-bromothiophen-2-yl)methoxy]pyridine.
What is the SMILES notation for 2-(bromomethyl)-5-[(5-bromothiophen-2-yl)methoxy]pyridine?
The canonical SMILES for 2-(bromomethyl)-5-[(5-bromothiophen-2-yl)methoxy]pyridine is BrCc1ccc(OCc2ccc(Br)s2)cn1.
What is the InChIKey of 2-(bromomethyl)-5-[(5-bromothiophen-2-yl)methoxy]pyridine?
The InChIKey is GRXBPPTZVSIVBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9Br2NOS/c12-5-8-1-2-9(6-14-8)15-7-10-3-4-11(13)16-10/h1-4,6H,5,7H2.
What are the key properties of 2-(bromomethyl)-5-[(5-bromothiophen-2-yl)methoxy]pyridine?
2-(bromomethyl)-5-[(5-bromothiophen-2-yl)methoxy]pyridine has a molecular weight of 363.07 g/mol, XLogP of 4.38, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(bromomethyl)-5-[(5-bromothiophen-2-yl)methoxy]pyridine is sourced from PubChem (CID 79800755), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).