ethyl 3-ethylpiperidine-2-carboxylate

C10H19NO2 — CID 144594238

IUPACethyl 3-ethylpiperidine-2-carboxylate
SMILESCCOC(=O)C1NCCCC1CC
InChIInChI=1S/C10H19NO2/c1-3-8-6-5-7-11-9(8)10(12)13-4-2/h8-9,11H,3-7H2,1-2H3
InChIKeyAMUQWZQJEGTZSO-UHFFFAOYSA-N
MW185.27 g/mol
LogP1.33
Rot. Bonds3

About ethyl 3-ethylpiperidine-2-carboxylate

ethyl 3-ethylpiperidine-2-carboxylate (PubChem CID 144594238) has the molecular formula C10H19NO2 and a molecular weight of 185.27 g/mol. Its IUPAC name is ethyl 3-ethylpiperidine-2-carboxylate.

Molecular Properties

Compound Nameethyl 3-ethylpiperidine-2-carboxylate
PubChem CID144594238
Molecular FormulaC10H19NO2
Molecular Weight185.27 g/mol
Exact Mass185.14
IUPAC Nameethyl 3-ethylpiperidine-2-carboxylate
SMILESCCOC(=O)C1NCCCC1CC
InChIInChI=1S/C10H19NO2/c1-3-8-6-5-7-11-9(8)10(12)13-4-2/h8-9,11H,3-7H2,1-2H3
InChIKeyAMUQWZQJEGTZSO-UHFFFAOYSA-N
XLogP1.33
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.27
LogP ≤ 51.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

Ethyl piperidine-2-carboxylate
CID 27517
Methyl pipecolinate
CID 3463753
(6R)-butyl 6-methylpiperidine-2-carboxylate hydrochloride
CID 9551733
Ethyl pipecolinate hydrochloride
CID 12436225
(2R,4R)-4-methylpiperidine-2-carboxylic acid
CID 5288786
Butyl 6-methyl-2-piperidinecarboxylate hydrochloride
CID 2834679
Dibutyl piperidine-2,6-dicarboxylate
CID 6602935
Butyl 6-methylpiperidine-2-carboxylate
CID 2834680
Methyl 4-methylpiperidine-2-carboxylate
CID 15511834
Ethyl 2-(piperidin-3-yl)acetate
CID 2760464
Tert-butyl piperidine-2-carboxylate
CID 4180856
ethyl 2-[(3R)-piperidin-3-yl]acetate
CID 7161133

Frequently Asked Questions

What is the IUPAC name of ethyl 3-ethylpiperidine-2-carboxylate?
The IUPAC name of ethyl 3-ethylpiperidine-2-carboxylate (CID 144594238) is ethyl 3-ethylpiperidine-2-carboxylate.
What is the SMILES notation for ethyl 3-ethylpiperidine-2-carboxylate?
The canonical SMILES for ethyl 3-ethylpiperidine-2-carboxylate is CCOC(=O)C1NCCCC1CC.
What is the InChIKey of ethyl 3-ethylpiperidine-2-carboxylate?
The InChIKey is AMUQWZQJEGTZSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO2/c1-3-8-6-5-7-11-9(8)10(12)13-4-2/h8-9,11H,3-7H2,1-2H3.
What are the key properties of ethyl 3-ethylpiperidine-2-carboxylate?
ethyl 3-ethylpiperidine-2-carboxylate has a molecular weight of 185.27 g/mol, XLogP of 1.33, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 3-ethylpiperidine-2-carboxylate is sourced from PubChem (CID 144594238), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).