ethyl 2-(pyridin-2-ylmethylamino)acetate

C10H14N2O2 — CID 13236080

IUPACethyl 2-(pyridin-2-ylmethylamino)acetate
SMILESCCOC(=O)CNCc1ccccn1
InChIInChI=1S/C10H14N2O2/c1-2-14-10(13)8-11-7-9-5-3-4-6-12-9/h3-6,11H,2,7-8H2,1H3
InChIKeyUCSBXEQEHOOKHG-UHFFFAOYSA-N
MW194.23 g/mol
LogP0.73
Rot. Bonds5

About ethyl 2-(pyridin-2-ylmethylamino)acetate

ethyl 2-(pyridin-2-ylmethylamino)acetate (PubChem CID 13236080) has the molecular formula C10H14N2O2 and a molecular weight of 194.23 g/mol. Its IUPAC name is ethyl 2-(pyridin-2-ylmethylamino)acetate.

Molecular Properties

Compound Nameethyl 2-(pyridin-2-ylmethylamino)acetate
PubChem CID13236080
Molecular FormulaC10H14N2O2
Molecular Weight194.23 g/mol
Exact Mass194.11
IUPAC Nameethyl 2-(pyridin-2-ylmethylamino)acetate
SMILESCCOC(=O)CNCc1ccccn1
InChIInChI=1S/C10H14N2O2/c1-2-14-10(13)8-11-7-9-5-3-4-6-12-9/h3-6,11H,2,7-8H2,1H3
InChIKeyUCSBXEQEHOOKHG-UHFFFAOYSA-N
XLogP0.73
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.23
LogP ≤ 50.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze ethyl 2-(pyridin-2-ylmethylamino)acetate 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 ethyl 2-(pyridin-2-ylmethylamino)acetate?
The IUPAC name of ethyl 2-(pyridin-2-ylmethylamino)acetate (CID 13236080) is ethyl 2-(pyridin-2-ylmethylamino)acetate.
What is the SMILES notation for ethyl 2-(pyridin-2-ylmethylamino)acetate?
The canonical SMILES for ethyl 2-(pyridin-2-ylmethylamino)acetate is CCOC(=O)CNCc1ccccn1.
What is the InChIKey of ethyl 2-(pyridin-2-ylmethylamino)acetate?
The InChIKey is UCSBXEQEHOOKHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O2/c1-2-14-10(13)8-11-7-9-5-3-4-6-12-9/h3-6,11H,2,7-8H2,1H3.
What are the key properties of ethyl 2-(pyridin-2-ylmethylamino)acetate?
ethyl 2-(pyridin-2-ylmethylamino)acetate has a molecular weight of 194.23 g/mol, XLogP of 0.73, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-(pyridin-2-ylmethylamino)acetate is sourced from PubChem (CID 13236080), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).