ethyl 1-(2-piperidin-3-ylacetyl)piperidine-2-carboxylate

C15H26N2O3 — CID 62676158

IUPACethyl 1-(2-piperidin-3-ylacetyl)piperidine-2-carboxylate
SMILESCCOC(=O)C1CCCCN1C(=O)CC1CCCNC1
InChIInChI=1S/C15H26N2O3/c1-2-20-15(19)13-7-3-4-9-17(13)14(18)10-12-6-5-8-16-11-12/h12-13,16H,2-11H2,1H3
InChIKeyQFELLLFSWTWNCS-UHFFFAOYSA-N
MW282.38 g/mol
LogP1.32
Rot. Bonds4

About ethyl 1-(2-piperidin-3-ylacetyl)piperidine-2-carboxylate

ethyl 1-(2-piperidin-3-ylacetyl)piperidine-2-carboxylate (PubChem CID 62676158) has the molecular formula C15H26N2O3 and a molecular weight of 282.38 g/mol. Its IUPAC name is ethyl 1-(2-piperidin-3-ylacetyl)piperidine-2-carboxylate.

Molecular Properties

Compound Nameethyl 1-(2-piperidin-3-ylacetyl)piperidine-2-carboxylate
PubChem CID62676158
Molecular FormulaC15H26N2O3
Molecular Weight282.38 g/mol
Exact Mass282.19
IUPAC Nameethyl 1-(2-piperidin-3-ylacetyl)piperidine-2-carboxylate
SMILESCCOC(=O)C1CCCCN1C(=O)CC1CCCNC1
InChIInChI=1S/C15H26N2O3/c1-2-20-15(19)13-7-3-4-9-17(13)14(18)10-12-6-5-8-16-11-12/h12-13,16H,2-11H2,1H3
InChIKeyQFELLLFSWTWNCS-UHFFFAOYSA-N
XLogP1.32
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.38
LogP ≤ 51.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze ethyl 1-(2-piperidin-3-ylacetyl)piperidine-2-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

ethyl 1-(2-cyclopentylacetyl)pyrrolidine-2-carboxylate
CID 55005769
ethyl 1-(2-cycloheptylacetyl)piperazine-2-carboxylate
CID 115737538
ethyl 1-[(3R)-piperidine-3-carbonyl]piperidine-2-carboxylate
CID 81128745
ethyl 1-(2-morpholin-2-ylacetyl)piperidine-2-carboxylate
CID 66427655
ethyl 1-[2-(piperidin-3-ylamino)acetyl]pyrrolidine-2-carboxylate
CID 91282488
ethyl 1-[2-(3-methylazetidin-3-yl)oxyacetyl]piperidine-2-carboxylate
CID 102655936
ethyl 1-[2-(1,1-dioxothiolan-3-yl)acetyl]piperidine-2-carboxylate
CID 78915883
ethyl 2-[(3S)-piperidin-3-yl]acetate
CID 7016849
ethyl 1-propanoylpyrrolidine-2-carboxylate
CID 11845503
ethyl 1-(3-piperidin-2-ylpropanoyl)piperidine-2-carboxylate
CID 62210746
ethyl 1-[C-(hydroxymethyl)-N-piperidin-3-ylcarbonimidoyl]pyrrolidine-2-carboxylate
CID 91454243
ethyl (2R)-1-[6-[(2R)-2-ethoxycarbonylpyrrolidin-1-yl]-6-oxohexanoyl]pyrrolidine-2-carboxylate
CID 10150705

Frequently Asked Questions

What is the IUPAC name of ethyl 1-(2-piperidin-3-ylacetyl)piperidine-2-carboxylate?
The IUPAC name of ethyl 1-(2-piperidin-3-ylacetyl)piperidine-2-carboxylate (CID 62676158) is ethyl 1-(2-piperidin-3-ylacetyl)piperidine-2-carboxylate.
What is the SMILES notation for ethyl 1-(2-piperidin-3-ylacetyl)piperidine-2-carboxylate?
The canonical SMILES for ethyl 1-(2-piperidin-3-ylacetyl)piperidine-2-carboxylate is CCOC(=O)C1CCCCN1C(=O)CC1CCCNC1.
What is the InChIKey of ethyl 1-(2-piperidin-3-ylacetyl)piperidine-2-carboxylate?
The InChIKey is QFELLLFSWTWNCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O3/c1-2-20-15(19)13-7-3-4-9-17(13)14(18)10-12-6-5-8-16-11-12/h12-13,16H,2-11H2,1H3.
What are the key properties of ethyl 1-(2-piperidin-3-ylacetyl)piperidine-2-carboxylate?
ethyl 1-(2-piperidin-3-ylacetyl)piperidine-2-carboxylate has a molecular weight of 282.38 g/mol, XLogP of 1.32, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 1-(2-piperidin-3-ylacetyl)piperidine-2-carboxylate is sourced from PubChem (CID 62676158), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).