3-bromo-2-(2-piperidin-1-ylethoxy)pyridine

C12H17BrN2O — CID 55136336

IUPAC3-bromo-2-(2-piperidin-1-ylethoxy)pyridine
SMILESBrc1cccnc1OCCN1CCCCC1
InChIInChI=1S/C12H17BrN2O/c13-11-5-4-6-14-12(11)16-10-9-15-7-2-1-3-8-15/h4-6H,1-3,7-10H2
InChIKeyNFTOKWIYAZVDKY-UHFFFAOYSA-N
MW285.18 g/mol
LogP2.71
Rot. Bonds4

About 3-bromo-2-(2-piperidin-1-ylethoxy)pyridine

3-bromo-2-(2-piperidin-1-ylethoxy)pyridine (PubChem CID 55136336) has the molecular formula C12H17BrN2O and a molecular weight of 285.18 g/mol. Its IUPAC name is 3-bromo-2-(2-piperidin-1-ylethoxy)pyridine.

Molecular Properties

Compound Name3-bromo-2-(2-piperidin-1-ylethoxy)pyridine
PubChem CID55136336
Molecular FormulaC12H17BrN2O
Molecular Weight285.18 g/mol
Exact Mass284.05
IUPAC Name3-bromo-2-(2-piperidin-1-ylethoxy)pyridine
SMILESBrc1cccnc1OCCN1CCCCC1
InChIInChI=1S/C12H17BrN2O/c13-11-5-4-6-14-12(11)16-10-9-15-7-2-1-3-8-15/h4-6H,1-3,7-10H2
InChIKeyNFTOKWIYAZVDKY-UHFFFAOYSA-N
XLogP2.71
TPSA25.36 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.18
LogP ≤ 52.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

3-(chloromethyl)-2-(2-piperidin-1-ylethoxy)pyridine
CID 61267879
3-bromo-2-(2-pyrrolidin-1-ylethyl)pyridine
CID 83919940
5-bromo-4-(2-piperidin-1-ylethoxy)pyrimidin-2-amine
CID 80870583
3-bromo-2-(2-cyclobutylethoxy)pyridine
CID 106203696
3-[(3-bromo-2-pyridinyl)oxy]propan-1-ol
CID 61375068
1-[3-(2-bromophenoxy)propyl]azepane
CID 2195329
1-[2-[2-(2-bromophenoxy)ethoxy]ethyl]piperidine
CID 31196285
6-(2-pyrrolidin-1-ylethoxy)quinolin-5-amine
CID 61102865
3-bromo-2-(4,4,4-trifluorobutoxy)pyridine
CID 82788804
1,2-bis[2-[2-(azocan-1-yl)ethoxy]phenyl]ethane-1,2-dione
CID 21486308
[1-(2-piperidin-1-ylethoxy)isoquinolin-4-yl]methanol
CID 106768736
4-(2-piperidin-1-ylethoxy)quinazolin-2-amine
CID 80871304

Frequently Asked Questions

What is the IUPAC name of 3-bromo-2-(2-piperidin-1-ylethoxy)pyridine?
The IUPAC name of 3-bromo-2-(2-piperidin-1-ylethoxy)pyridine (CID 55136336) is 3-bromo-2-(2-piperidin-1-ylethoxy)pyridine.
What is the SMILES notation for 3-bromo-2-(2-piperidin-1-ylethoxy)pyridine?
The canonical SMILES for 3-bromo-2-(2-piperidin-1-ylethoxy)pyridine is Brc1cccnc1OCCN1CCCCC1.
What is the InChIKey of 3-bromo-2-(2-piperidin-1-ylethoxy)pyridine?
The InChIKey is NFTOKWIYAZVDKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17BrN2O/c13-11-5-4-6-14-12(11)16-10-9-15-7-2-1-3-8-15/h4-6H,1-3,7-10H2.
What are the key properties of 3-bromo-2-(2-piperidin-1-ylethoxy)pyridine?
3-bromo-2-(2-piperidin-1-ylethoxy)pyridine has a molecular weight of 285.18 g/mol, XLogP of 2.71, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-bromo-2-(2-piperidin-1-ylethoxy)pyridine is sourced from PubChem (CID 55136336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).