5-bromo-3-chloro-2-(2-piperidin-3-ylethoxy)pyridine

C12H16BrClN2O — CID 103583976

IUPAC5-bromo-3-chloro-2-(2-piperidin-3-ylethoxy)pyridine
SMILESClc1cc(Br)cnc1OCCC1CCCNC1
InChIInChI=1S/C12H16BrClN2O/c13-10-6-11(14)12(16-8-10)17-5-3-9-2-1-4-15-7-9/h6,8-9,15H,1-5,7H2
InChIKeyZAYXJKVVZXWIKC-UHFFFAOYSA-N
MW319.63 g/mol
LogP3.27
Rot. Bonds4

About 5-bromo-3-chloro-2-(2-piperidin-3-ylethoxy)pyridine

5-bromo-3-chloro-2-(2-piperidin-3-ylethoxy)pyridine (PubChem CID 103583976) has the molecular formula C12H16BrClN2O and a molecular weight of 319.63 g/mol. Its IUPAC name is 5-bromo-3-chloro-2-(2-piperidin-3-ylethoxy)pyridine.

Molecular Properties

Compound Name5-bromo-3-chloro-2-(2-piperidin-3-ylethoxy)pyridine
PubChem CID103583976
Molecular FormulaC12H16BrClN2O
Molecular Weight319.63 g/mol
Exact Mass318.01
IUPAC Name5-bromo-3-chloro-2-(2-piperidin-3-ylethoxy)pyridine
SMILESClc1cc(Br)cnc1OCCC1CCCNC1
InChIInChI=1S/C12H16BrClN2O/c13-10-6-11(14)12(16-8-10)17-5-3-9-2-1-4-15-7-9/h6,8-9,15H,1-5,7H2
InChIKeyZAYXJKVVZXWIKC-UHFFFAOYSA-N
XLogP3.27
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.63
LogP ≤ 53.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 5-bromo-3-chloro-2-(2-piperidin-3-ylethoxy)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

5-bromo-2-(2-piperidin-3-ylethoxy)-3-(trifluoromethyl)pyridine
CID 106796833
3-chloro-2-[2-[(3R)-piperidin-3-yl]ethoxy]-5-(trifluoromethyl)pyridine
CID 94409728
3-chloro-2-(2-piperidin-3-ylethoxy)-5-(trifluoromethyl)pyridine
CID 62358361
3-chloro-2-(2-pyrrolidin-3-ylethoxy)-5-(trifluoromethyl)pyridine
CID 114796299
5-chloro-4-(2-piperidin-3-ylethoxy)-1H-pyrimidin-6-one
CID 114586434
5-bromo-3-chloro-N-methyl-N-(piperidin-3-ylmethyl)pyridin-2-amine
CID 106642794
3,5-dibromo-2-(2-cyclobutylethoxy)pyridine
CID 106203686
(3S)-3-[2-(2-chloro-4-methylphenoxy)ethyl]piperidine
CID 86320313
(3S)-3-[2-(2-chloro-4,6-dimethylphenoxy)ethyl]piperidine
CID 86320246
(3R)-3-[2-(2,4-dichlorophenoxy)ethyl]piperidine
CID 86320969
3-[2-(3-chlorophenoxy)ethyl]piperidine
CID 22309129
2-methyl-3-[2-[(3R)-piperidin-3-yl]ethoxy]pyrazine
CID 97163244

Frequently Asked Questions

What is the IUPAC name of 5-bromo-3-chloro-2-(2-piperidin-3-ylethoxy)pyridine?
The IUPAC name of 5-bromo-3-chloro-2-(2-piperidin-3-ylethoxy)pyridine (CID 103583976) is 5-bromo-3-chloro-2-(2-piperidin-3-ylethoxy)pyridine.
What is the SMILES notation for 5-bromo-3-chloro-2-(2-piperidin-3-ylethoxy)pyridine?
The canonical SMILES for 5-bromo-3-chloro-2-(2-piperidin-3-ylethoxy)pyridine is Clc1cc(Br)cnc1OCCC1CCCNC1.
What is the InChIKey of 5-bromo-3-chloro-2-(2-piperidin-3-ylethoxy)pyridine?
The InChIKey is ZAYXJKVVZXWIKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16BrClN2O/c13-10-6-11(14)12(16-8-10)17-5-3-9-2-1-4-15-7-9/h6,8-9,15H,1-5,7H2.
What are the key properties of 5-bromo-3-chloro-2-(2-piperidin-3-ylethoxy)pyridine?
5-bromo-3-chloro-2-(2-piperidin-3-ylethoxy)pyridine has a molecular weight of 319.63 g/mol, XLogP of 3.27, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-3-chloro-2-(2-piperidin-3-ylethoxy)pyridine is sourced from PubChem (CID 103583976), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).