ethyl 2-(4-aminopiperidin-1-yl)acetate

C9H18N2O2 — CID 16775205

IUPACethyl 2-(4-aminopiperidin-1-yl)acetate
SMILESCCOC(=O)CN1CCC(N)CC1
InChIInChI=1S/C9H18N2O2/c1-2-13-9(12)7-11-5-3-8(10)4-6-11/h8H,2-7,10H2,1H3
InChIKeyKEDYVZWXUHWODZ-UHFFFAOYSA-N
MW186.25 g/mol
LogP-0.03
Rot. Bonds3

About ethyl 2-(4-aminopiperidin-1-yl)acetate

ethyl 2-(4-aminopiperidin-1-yl)acetate (PubChem CID 16775205) has the molecular formula C9H18N2O2 and a molecular weight of 186.25 g/mol. Its IUPAC name is ethyl 2-(4-aminopiperidin-1-yl)acetate.

Molecular Properties

Compound Nameethyl 2-(4-aminopiperidin-1-yl)acetate
PubChem CID16775205
Molecular FormulaC9H18N2O2
Molecular Weight186.25 g/mol
Exact Mass186.14
IUPAC Nameethyl 2-(4-aminopiperidin-1-yl)acetate
SMILESCCOC(=O)CN1CCC(N)CC1
InChIInChI=1S/C9H18N2O2/c1-2-13-9(12)7-11-5-3-8(10)4-6-11/h8H,2-7,10H2,1H3
InChIKeyKEDYVZWXUHWODZ-UHFFFAOYSA-N
XLogP-0.03
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.25
LogP ≤ 5-0.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze ethyl 2-(4-aminopiperidin-1-yl)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-(4-aminopiperidin-1-yl)acetate?
The IUPAC name of ethyl 2-(4-aminopiperidin-1-yl)acetate (CID 16775205) is ethyl 2-(4-aminopiperidin-1-yl)acetate.
What is the SMILES notation for ethyl 2-(4-aminopiperidin-1-yl)acetate?
The canonical SMILES for ethyl 2-(4-aminopiperidin-1-yl)acetate is CCOC(=O)CN1CCC(N)CC1.
What is the InChIKey of ethyl 2-(4-aminopiperidin-1-yl)acetate?
The InChIKey is KEDYVZWXUHWODZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2O2/c1-2-13-9(12)7-11-5-3-8(10)4-6-11/h8H,2-7,10H2,1H3.
What are the key properties of ethyl 2-(4-aminopiperidin-1-yl)acetate?
ethyl 2-(4-aminopiperidin-1-yl)acetate has a molecular weight of 186.25 g/mol, XLogP of -0.03, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-(4-aminopiperidin-1-yl)acetate is sourced from PubChem (CID 16775205), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).