2-(diethylamino)ethyl 3-piperidin-4-ylpropanoate;hydrochloride

C14H29ClN2O2 — CID 54603666

IUPAC2-(diethylamino)ethyl 3-piperidin-4-ylpropanoate;hydrochloride
SMILESCCN(CC)CCOC(=O)CCC1CCNCC1.Cl
InChIInChI=1S/C14H28N2O2.ClH/c1-3-16(4-2)11-12-18-14(17)6-5-13-7-9-15-10-8-13;/h13,15H,3-12H2,1-2H3;1H
InChIKeyOILRPILUQNISFF-UHFFFAOYSA-N
MW292.85 g/mol
LogP2.07
Rot. Bonds8

About 2-(diethylamino)ethyl 3-piperidin-4-ylpropanoate;hydrochloride

2-(diethylamino)ethyl 3-piperidin-4-ylpropanoate;hydrochloride (PubChem CID 54603666) has the molecular formula C14H29ClN2O2 and a molecular weight of 292.85 g/mol. Its IUPAC name is 2-(diethylamino)ethyl 3-piperidin-4-ylpropanoate;hydrochloride.

Molecular Properties

Compound Name2-(diethylamino)ethyl 3-piperidin-4-ylpropanoate;hydrochloride
PubChem CID54603666
Molecular FormulaC14H29ClN2O2
Molecular Weight292.85 g/mol
Exact Mass292.19
IUPAC Name2-(diethylamino)ethyl 3-piperidin-4-ylpropanoate;hydrochloride
SMILESCCN(CC)CCOC(=O)CCC1CCNCC1.Cl
InChIInChI=1S/C14H28N2O2.ClH/c1-3-16(4-2)11-12-18-14(17)6-5-13-7-9-15-10-8-13;/h13,15H,3-12H2,1-2H3;1H
InChIKeyOILRPILUQNISFF-UHFFFAOYSA-N
XLogP2.07
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.85
LogP ≤ 52.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(diethylamino)ethyl 3-piperidin-4-ylpropanoate;dihydrochloride
CID 131858012
ethyl 3-piperidin-4-ylpropanoate;hydrochloride
CID 23062703
2-piperidin-4-ylethyl butanoate
CID 174737441
propanoyl 3-piperidin-4-ylpropanoate;hydrochloride
CID 174378538
ethyl 3-(azepan-4-yl)propanoate;hydrochloride
CID 126845771
N,N-diethyl-2-(2-piperidin-4-ylethoxy)ethanamine
CID 15057325
2-piperidin-4-ylethyl propanoate
CID 53408774
N-[3-(diethylamino)propyl]-N-ethyl-3-piperidin-4-ylpropanamide
CID 102992986
2-(diethylamino)ethyl N-piperidin-4-ylcarbamate
CID 15676972
4-oxo-4-(2-piperidin-4-ylethoxy)butanoic acid
CID 175797428
ethyl 4-piperidin-4-ylbutanoate
CID 10631848
2-(diethylamino)ethyl propanoate;hydrochloride
CID 141390423

Frequently Asked Questions

What is the IUPAC name of 2-(diethylamino)ethyl 3-piperidin-4-ylpropanoate;hydrochloride?
The IUPAC name of 2-(diethylamino)ethyl 3-piperidin-4-ylpropanoate;hydrochloride (CID 54603666) is 2-(diethylamino)ethyl 3-piperidin-4-ylpropanoate;hydrochloride.
What is the SMILES notation for 2-(diethylamino)ethyl 3-piperidin-4-ylpropanoate;hydrochloride?
The canonical SMILES for 2-(diethylamino)ethyl 3-piperidin-4-ylpropanoate;hydrochloride is CCN(CC)CCOC(=O)CCC1CCNCC1.Cl.
What is the InChIKey of 2-(diethylamino)ethyl 3-piperidin-4-ylpropanoate;hydrochloride?
The InChIKey is OILRPILUQNISFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O2.ClH/c1-3-16(4-2)11-12-18-14(17)6-5-13-7-9-15-10-8-13;/h13,15H,3-12H2,1-2H3;1H.
What are the key properties of 2-(diethylamino)ethyl 3-piperidin-4-ylpropanoate;hydrochloride?
2-(diethylamino)ethyl 3-piperidin-4-ylpropanoate;hydrochloride has a molecular weight of 292.85 g/mol, XLogP of 2.07, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(diethylamino)ethyl 3-piperidin-4-ylpropanoate;hydrochloride is sourced from PubChem (CID 54603666), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).