2-[1-(6-ethoxy-2-pyridinyl)piperidin-4-yl]ethanamine

C14H23N3O — CID 63586487

IUPAC2-[1-(6-ethoxy-2-pyridinyl)piperidin-4-yl]ethanamine
SMILESCCOc1cccc(N2CCC(CCN)CC2)n1
InChIInChI=1S/C14H23N3O/c1-2-18-14-5-3-4-13(16-14)17-10-7-12(6-9-15)8-11-17/h3-5,12H,2,6-11,15H2,1H3
InChIKeyJEMNJUKXACQGDP-UHFFFAOYSA-N
MW249.36 g/mol
LogP2.05
Rot. Bonds5

About 2-[1-(6-ethoxy-2-pyridinyl)piperidin-4-yl]ethanamine

2-[1-(6-ethoxy-2-pyridinyl)piperidin-4-yl]ethanamine (PubChem CID 63586487) has the molecular formula C14H23N3O and a molecular weight of 249.36 g/mol. Its IUPAC name is 2-[1-(6-ethoxy-2-pyridinyl)piperidin-4-yl]ethanamine.

Molecular Properties

Compound Name2-[1-(6-ethoxy-2-pyridinyl)piperidin-4-yl]ethanamine
PubChem CID63586487
Molecular FormulaC14H23N3O
Molecular Weight249.36 g/mol
Exact Mass249.18
IUPAC Name2-[1-(6-ethoxy-2-pyridinyl)piperidin-4-yl]ethanamine
SMILESCCOc1cccc(N2CCC(CCN)CC2)n1
InChIInChI=1S/C14H23N3O/c1-2-18-14-5-3-4-13(16-14)17-10-7-12(6-9-15)8-11-17/h3-5,12H,2,6-11,15H2,1H3
InChIKeyJEMNJUKXACQGDP-UHFFFAOYSA-N
XLogP2.05
TPSA51.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.36
LogP ≤ 52.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[1-(6-ethoxy-2-pyridinyl)piperidin-4-yl]ethanamine?
The IUPAC name of 2-[1-(6-ethoxy-2-pyridinyl)piperidin-4-yl]ethanamine (CID 63586487) is 2-[1-(6-ethoxy-2-pyridinyl)piperidin-4-yl]ethanamine.
What is the SMILES notation for 2-[1-(6-ethoxy-2-pyridinyl)piperidin-4-yl]ethanamine?
The canonical SMILES for 2-[1-(6-ethoxy-2-pyridinyl)piperidin-4-yl]ethanamine is CCOc1cccc(N2CCC(CCN)CC2)n1.
What is the InChIKey of 2-[1-(6-ethoxy-2-pyridinyl)piperidin-4-yl]ethanamine?
The InChIKey is JEMNJUKXACQGDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O/c1-2-18-14-5-3-4-13(16-14)17-10-7-12(6-9-15)8-11-17/h3-5,12H,2,6-11,15H2,1H3.
What are the key properties of 2-[1-(6-ethoxy-2-pyridinyl)piperidin-4-yl]ethanamine?
2-[1-(6-ethoxy-2-pyridinyl)piperidin-4-yl]ethanamine has a molecular weight of 249.36 g/mol, XLogP of 2.05, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(6-ethoxy-2-pyridinyl)piperidin-4-yl]ethanamine is sourced from PubChem (CID 63586487), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).