2-ethoxy-4-piperidin-4-ylpyridine;methane

C13H22N2O — CID 158415857

IUPAC2-ethoxy-4-piperidin-4-ylpyridine;methane
SMILESC.CCOc1cc(C2CCNCC2)ccn1
InChIInChI=1S/C12H18N2O.CH4/c1-2-15-12-9-11(5-8-14-12)10-3-6-13-7-4-10;/h5,8-10,13H,2-4,6-7H2,1H3;1H4
InChIKeyGZWQAABJZUIDKD-UHFFFAOYSA-N
MW222.33 g/mol
LogP2.58
Rot. Bonds3

About 2-ethoxy-4-piperidin-4-ylpyridine;methane

2-ethoxy-4-piperidin-4-ylpyridine;methane (PubChem CID 158415857) has the molecular formula C13H22N2O and a molecular weight of 222.33 g/mol. Its IUPAC name is 2-ethoxy-4-piperidin-4-ylpyridine;methane.

Molecular Properties

Compound Name2-ethoxy-4-piperidin-4-ylpyridine;methane
PubChem CID158415857
Molecular FormulaC13H22N2O
Molecular Weight222.33 g/mol
Exact Mass222.17
IUPAC Name2-ethoxy-4-piperidin-4-ylpyridine;methane
SMILESC.CCOc1cc(C2CCNCC2)ccn1
InChIInChI=1S/C12H18N2O.CH4/c1-2-15-12-9-11(5-8-14-12)10-3-6-13-7-4-10;/h5,8-10,13H,2-4,6-7H2,1H3;1H4
InChIKeyGZWQAABJZUIDKD-UHFFFAOYSA-N
XLogP2.58
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.33
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-ethoxy-4-piperidin-4-ylpyridine;methane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-4-piperidin-4-ylpyridine;methane?
The IUPAC name of 2-ethoxy-4-piperidin-4-ylpyridine;methane (CID 158415857) is 2-ethoxy-4-piperidin-4-ylpyridine;methane.
What is the SMILES notation for 2-ethoxy-4-piperidin-4-ylpyridine;methane?
The canonical SMILES for 2-ethoxy-4-piperidin-4-ylpyridine;methane is C.CCOc1cc(C2CCNCC2)ccn1.
What is the InChIKey of 2-ethoxy-4-piperidin-4-ylpyridine;methane?
The InChIKey is GZWQAABJZUIDKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O.CH4/c1-2-15-12-9-11(5-8-14-12)10-3-6-13-7-4-10;/h5,8-10,13H,2-4,6-7H2,1H3;1H4.
What are the key properties of 2-ethoxy-4-piperidin-4-ylpyridine;methane?
2-ethoxy-4-piperidin-4-ylpyridine;methane has a molecular weight of 222.33 g/mol, XLogP of 2.58, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-4-piperidin-4-ylpyridine;methane is sourced from PubChem (CID 158415857), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).