3-(2-pyridin-3-ylethoxy)-8-azabicyclo[3.2.1]octane

C14H20N2O — CID 114199673

IUPAC3-(2-pyridin-3-ylethoxy)-8-azabicyclo[3.2.1]octane
SMILESc1cncc(CCOC2CC3CCC(C2)N3)c1
InChIInChI=1S/C14H20N2O/c1-2-11(10-15-6-1)5-7-17-14-8-12-3-4-13(9-14)16-12/h1-2,6,10,12-14,16H,3-5,7-9H2
InChIKeyNGNVBCIKQMMWTI-UHFFFAOYSA-N
MW232.33 g/mol
LogP1.92
Rot. Bonds4

About 3-(2-pyridin-3-ylethoxy)-8-azabicyclo[3.2.1]octane

3-(2-pyridin-3-ylethoxy)-8-azabicyclo[3.2.1]octane (PubChem CID 114199673) has the molecular formula C14H20N2O and a molecular weight of 232.33 g/mol. Its IUPAC name is 3-(2-pyridin-3-ylethoxy)-8-azabicyclo[3.2.1]octane.

Molecular Properties

Compound Name3-(2-pyridin-3-ylethoxy)-8-azabicyclo[3.2.1]octane
PubChem CID114199673
Molecular FormulaC14H20N2O
Molecular Weight232.33 g/mol
Exact Mass232.16
IUPAC Name3-(2-pyridin-3-ylethoxy)-8-azabicyclo[3.2.1]octane
SMILESc1cncc(CCOC2CC3CCC(C2)N3)c1
InChIInChI=1S/C14H20N2O/c1-2-11(10-15-6-1)5-7-17-14-8-12-3-4-13(9-14)16-12/h1-2,6,10,12-14,16H,3-5,7-9H2
InChIKeyNGNVBCIKQMMWTI-UHFFFAOYSA-N
XLogP1.92
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.33
LogP ≤ 51.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-propyl-N-(2-pyridin-3-ylethyl)-8-azabicyclo[3.2.1]octan-3-amine
CID 63262796
O-(2-pyridin-3-ylethyl)hydroxylamine;dihydrochloride
CID 45158549
2-(8-azabicyclo[3.2.1]octan-3-yl)-N-(pyridin-3-ylmethyl)acetamide
CID 79607003
3-[3-(piperidin-4-ylmethoxy)propyl]pyridine
CID 44784866
3-(2-cyclobutylethyl)pyridine
CID 57204476
3-(pyridin-3-ylmethyl)pyridine
CID 14762640
3-pyridin-4-yloxy-8-azabicyclo[3.2.1]octane
CID 66754415
3-[[(3R)-pyrrolidin-3-yl]oxymethyl]pyridine;dihydrochloride
CID 66987447
3-[(4-methylcyclohexyl)oxymethyl]pyridine
CID 142207375
2-chloro-3-(2-pyridin-3-ylethoxy)pyridine
CID 65102137
N-(2-piperidin-4-yloxyethyl)-2-pyridin-3-ylacetamide
CID 63871778
2-piperidin-4-yloxy-N-(2-pyridin-3-ylethyl)acetamide
CID 55252246

Frequently Asked Questions

What is the IUPAC name of 3-(2-pyridin-3-ylethoxy)-8-azabicyclo[3.2.1]octane?
The IUPAC name of 3-(2-pyridin-3-ylethoxy)-8-azabicyclo[3.2.1]octane (CID 114199673) is 3-(2-pyridin-3-ylethoxy)-8-azabicyclo[3.2.1]octane.
What is the SMILES notation for 3-(2-pyridin-3-ylethoxy)-8-azabicyclo[3.2.1]octane?
The canonical SMILES for 3-(2-pyridin-3-ylethoxy)-8-azabicyclo[3.2.1]octane is c1cncc(CCOC2CC3CCC(C2)N3)c1.
What is the InChIKey of 3-(2-pyridin-3-ylethoxy)-8-azabicyclo[3.2.1]octane?
The InChIKey is NGNVBCIKQMMWTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O/c1-2-11(10-15-6-1)5-7-17-14-8-12-3-4-13(9-14)16-12/h1-2,6,10,12-14,16H,3-5,7-9H2.
What are the key properties of 3-(2-pyridin-3-ylethoxy)-8-azabicyclo[3.2.1]octane?
3-(2-pyridin-3-ylethoxy)-8-azabicyclo[3.2.1]octane has a molecular weight of 232.33 g/mol, XLogP of 1.92, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-pyridin-3-ylethoxy)-8-azabicyclo[3.2.1]octane is sourced from PubChem (CID 114199673), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).