ethyl 1-ethylpiperidine-4-carboxylate

C10H19NO2 — CID 11106043

IUPACethyl 1-ethylpiperidine-4-carboxylate
SMILESCCOC(=O)C1CCN(CC)CC1
InChIInChI=1S/C10H19NO2/c1-3-11-7-5-9(6-8-11)10(12)13-4-2/h9H,3-8H2,1-2H3
InChIKeyIYFCAAUQJJZDHW-UHFFFAOYSA-N
MW185.27 g/mol
LogP1.28
Rot. Bonds3

About ethyl 1-ethylpiperidine-4-carboxylate

ethyl 1-ethylpiperidine-4-carboxylate (PubChem CID 11106043) has the molecular formula C10H19NO2 and a molecular weight of 185.27 g/mol. Its IUPAC name is ethyl 1-ethylpiperidine-4-carboxylate.

Molecular Properties

Compound Nameethyl 1-ethylpiperidine-4-carboxylate
PubChem CID11106043
Molecular FormulaC10H19NO2
Molecular Weight185.27 g/mol
Exact Mass185.14
IUPAC Nameethyl 1-ethylpiperidine-4-carboxylate
SMILESCCOC(=O)C1CCN(CC)CC1
InChIInChI=1S/C10H19NO2/c1-3-11-7-5-9(6-8-11)10(12)13-4-2/h9H,3-8H2,1-2H3
InChIKeyIYFCAAUQJJZDHW-UHFFFAOYSA-N
XLogP1.28
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.27
LogP ≤ 51.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze ethyl 1-ethylpiperidine-4-carboxylate with MolForge

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

Launch Full Analysis

Related Compounds

benzene;ethyl 1-ethylpiperidine-4-carboxylate
CID 90944118
1-[2-(4-ethoxycarbonylpiperidin-1-yl)ethyl]piperidine-4-carboxylic acid
CID 172515768
ethyl 1-(2-aminoethyl)piperidine-4-carboxylate;dihydrochloride
CID 46172885
ethyl 1-(2-hydroxy-2-methylpropyl)piperidine-4-carboxylate
CID 60886735
ethyl 1-(cyanomethyl)piperidine-4-carboxylate
CID 20754608
ethyl 1-heptylpiperidine-4-carboxylate
CID 11777142
ethyl 1-methylpiperidine-4-carboxylate;hydrochloride
CID 52991957
ethyl 1-methanidylpiperidine-4-carboxylate
CID 21030013
2-(1-ethylpiperidine-4-carbonyl)oxyethylphosphonous acid
CID 145134556
ethyl 1-[2-(4-iodopiperazin-1-yl)ethyl]piperidine-4-carboxylate
CID 144962699
ethyl 1-[4-amino-3-(aminomethyl)-3-methylbutyl]piperidine-4-carboxylate
CID 123231259
4-ethoxycarbonylpiperidine-1-carboxylic acid
CID 21189657

Frequently Asked Questions

What is the IUPAC name of ethyl 1-ethylpiperidine-4-carboxylate?
The IUPAC name of ethyl 1-ethylpiperidine-4-carboxylate (CID 11106043) is ethyl 1-ethylpiperidine-4-carboxylate.
What is the SMILES notation for ethyl 1-ethylpiperidine-4-carboxylate?
The canonical SMILES for ethyl 1-ethylpiperidine-4-carboxylate is CCOC(=O)C1CCN(CC)CC1.
What is the InChIKey of ethyl 1-ethylpiperidine-4-carboxylate?
The InChIKey is IYFCAAUQJJZDHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO2/c1-3-11-7-5-9(6-8-11)10(12)13-4-2/h9H,3-8H2,1-2H3.
What are the key properties of ethyl 1-ethylpiperidine-4-carboxylate?
ethyl 1-ethylpiperidine-4-carboxylate has a molecular weight of 185.27 g/mol, XLogP of 1.28, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 1-ethylpiperidine-4-carboxylate is sourced from PubChem (CID 11106043), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).