2-hydroxyethyl 4-(diethylamino)piperidine-1-carboxylate

C12H24N2O3 — CID 79346546

IUPAC2-hydroxyethyl 4-(diethylamino)piperidine-1-carboxylate
SMILESCCN(CC)C1CCN(C(=O)OCCO)CC1
InChIInChI=1S/C12H24N2O3/c1-3-13(4-2)11-5-7-14(8-6-11)12(16)17-10-9-15/h11,15H,3-10H2,1-2H3
InChIKeyGEQJLGGZABEUPM-UHFFFAOYSA-N
MW244.33 g/mol
LogP0.92
Rot. Bonds5

About 2-hydroxyethyl 4-(diethylamino)piperidine-1-carboxylate

2-hydroxyethyl 4-(diethylamino)piperidine-1-carboxylate (PubChem CID 79346546) has the molecular formula C12H24N2O3 and a molecular weight of 244.33 g/mol. Its IUPAC name is 2-hydroxyethyl 4-(diethylamino)piperidine-1-carboxylate.

Molecular Properties

Compound Name2-hydroxyethyl 4-(diethylamino)piperidine-1-carboxylate
PubChem CID79346546
Molecular FormulaC12H24N2O3
Molecular Weight244.33 g/mol
Exact Mass244.18
IUPAC Name2-hydroxyethyl 4-(diethylamino)piperidine-1-carboxylate
SMILESCCN(CC)C1CCN(C(=O)OCCO)CC1
InChIInChI=1S/C12H24N2O3/c1-3-13(4-2)11-5-7-14(8-6-11)12(16)17-10-9-15/h11,15H,3-10H2,1-2H3
InChIKeyGEQJLGGZABEUPM-UHFFFAOYSA-N
XLogP0.92
TPSA53.01 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.33
LogP ≤ 50.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-hydroxyethyl 4-(diethylamino)piperidine-1-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

2-hydroxyethyl 4-(ethylsulfonylamino)piperidine-1-carboxylate
CID 79345168
2-hydroxyethyl 4-pyrrolidin-1-ylpiperidine-1-carboxylate
CID 79349412
2-[2-(2-hydroxyethoxy)ethoxy]ethyl 4-propan-2-ylpiperidine-1-carboxylate
CID 169283749
1-[4-[ethyl(2-hydroxyethyl)amino]piperidin-1-yl]ethanone
CID 66565461
ethyl 4-[ethyl(methyl)amino]piperidine-1-carboxylate
CID 143591988
2-amino-1-[4-(diethylamino)piperidin-1-yl]-2-methylpropan-1-one
CID 61264863
2-hydroxyethyl 3-(hydroxymethyl)pyrrolidine-1-carboxylate
CID 112629389
3-amino-1-[4-(diethylamino)piperidin-1-yl]propan-1-one
CID 60952932
(1-aminocyclopropyl)-[4-(diethylamino)piperidin-1-yl]methanone
CID 65466413
2-hydroxyethyl 4-(cyclopropanecarbonylamino)piperidine-1-carboxylate
CID 79346721
2-hydroxyethyl thiomorpholine-4-carboxylate
CID 79345320
propyl 4-sulfanylpiperidine-1-carboxylate
CID 142541970

Frequently Asked Questions

What is the IUPAC name of 2-hydroxyethyl 4-(diethylamino)piperidine-1-carboxylate?
The IUPAC name of 2-hydroxyethyl 4-(diethylamino)piperidine-1-carboxylate (CID 79346546) is 2-hydroxyethyl 4-(diethylamino)piperidine-1-carboxylate.
What is the SMILES notation for 2-hydroxyethyl 4-(diethylamino)piperidine-1-carboxylate?
The canonical SMILES for 2-hydroxyethyl 4-(diethylamino)piperidine-1-carboxylate is CCN(CC)C1CCN(C(=O)OCCO)CC1.
What is the InChIKey of 2-hydroxyethyl 4-(diethylamino)piperidine-1-carboxylate?
The InChIKey is GEQJLGGZABEUPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O3/c1-3-13(4-2)11-5-7-14(8-6-11)12(16)17-10-9-15/h11,15H,3-10H2,1-2H3.
What are the key properties of 2-hydroxyethyl 4-(diethylamino)piperidine-1-carboxylate?
2-hydroxyethyl 4-(diethylamino)piperidine-1-carboxylate has a molecular weight of 244.33 g/mol, XLogP of 0.92, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxyethyl 4-(diethylamino)piperidine-1-carboxylate is sourced from PubChem (CID 79346546), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).