ethyl 2-(cyclohexylamino)acetate

C10H19NO2 — CID 11679939

IUPACethyl 2-(cyclohexylamino)acetate
SMILESCCOC(=O)CNC1CCCCC1
InChIInChI=1S/C10H19NO2/c1-2-13-10(12)8-11-9-6-4-3-5-7-9/h9,11H,2-8H2,1H3
InChIKeyNHRFJPKXIYYFMX-UHFFFAOYSA-N
MW185.27 g/mol
LogP1.47
Rot. Bonds4

About ethyl 2-(cyclohexylamino)acetate

ethyl 2-(cyclohexylamino)acetate (PubChem CID 11679939) has the molecular formula C10H19NO2 and a molecular weight of 185.27 g/mol. Its IUPAC name is ethyl 2-(cyclohexylamino)acetate.

Molecular Properties

Compound Nameethyl 2-(cyclohexylamino)acetate
PubChem CID11679939
Molecular FormulaC10H19NO2
Molecular Weight185.27 g/mol
Exact Mass185.14
IUPAC Nameethyl 2-(cyclohexylamino)acetate
SMILESCCOC(=O)CNC1CCCCC1
InChIInChI=1S/C10H19NO2/c1-2-13-10(12)8-11-9-6-4-3-5-7-9/h9,11H,2-8H2,1H3
InChIKeyNHRFJPKXIYYFMX-UHFFFAOYSA-N
XLogP1.47
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.27
LogP ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze ethyl 2-(cyclohexylamino)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-(cyclohexylamino)acetate?
The IUPAC name of ethyl 2-(cyclohexylamino)acetate (CID 11679939) is ethyl 2-(cyclohexylamino)acetate.
What is the SMILES notation for ethyl 2-(cyclohexylamino)acetate?
The canonical SMILES for ethyl 2-(cyclohexylamino)acetate is CCOC(=O)CNC1CCCCC1.
What is the InChIKey of ethyl 2-(cyclohexylamino)acetate?
The InChIKey is NHRFJPKXIYYFMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO2/c1-2-13-10(12)8-11-9-6-4-3-5-7-9/h9,11H,2-8H2,1H3.
What are the key properties of ethyl 2-(cyclohexylamino)acetate?
ethyl 2-(cyclohexylamino)acetate has a molecular weight of 185.27 g/mol, XLogP of 1.47, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-(cyclohexylamino)acetate is sourced from PubChem (CID 11679939), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).