N-(2-piperidin-3-ylethyl)-1,4-dioxane-2-carboxamide

C12H22N2O3 — CID 62799919

IUPACN-(2-piperidin-3-ylethyl)-1,4-dioxane-2-carboxamide
SMILESO=C(NCCC1CCCNC1)C1COCCO1
InChIInChI=1S/C12H22N2O3/c15-12(11-9-16-6-7-17-11)14-5-3-10-2-1-4-13-8-10/h10-11,13H,1-9H2,(H,14,15)
InChIKeyWTIJGXXPTFIHFZ-UHFFFAOYSA-N
MW242.32 g/mol
LogP-0.09
Rot. Bonds4

About N-(2-piperidin-3-ylethyl)-1,4-dioxane-2-carboxamide

N-(2-piperidin-3-ylethyl)-1,4-dioxane-2-carboxamide (PubChem CID 62799919) has the molecular formula C12H22N2O3 and a molecular weight of 242.32 g/mol. Its IUPAC name is N-(2-piperidin-3-ylethyl)-1,4-dioxane-2-carboxamide.

Molecular Properties

Compound NameN-(2-piperidin-3-ylethyl)-1,4-dioxane-2-carboxamide
PubChem CID62799919
Molecular FormulaC12H22N2O3
Molecular Weight242.32 g/mol
Exact Mass242.16
IUPAC NameN-(2-piperidin-3-ylethyl)-1,4-dioxane-2-carboxamide
SMILESO=C(NCCC1CCCNC1)C1COCCO1
InChIInChI=1S/C12H22N2O3/c15-12(11-9-16-6-7-17-11)14-5-3-10-2-1-4-13-8-10/h10-11,13H,1-9H2,(H,14,15)
InChIKeyWTIJGXXPTFIHFZ-UHFFFAOYSA-N
XLogP-0.09
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.32
LogP ≤ 5-0.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-(2-piperidin-3-ylethyl)-1,4-dioxane-2-carboxamide 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

N-(2-pyrrolidin-3-ylethyl)oxane-2-carboxamide
CID 63629072
5-methyl-N-(2-piperidin-3-ylethyl)oxolane-2-carboxamide
CID 81331259
N-(2-piperidin-3-ylethyl)cyclobutanecarboxamide
CID 60894096
N-(2-piperidin-3-ylethyl)cyclobutanecarboxamide;hydrochloride
CID 119557894
3-(oxolan-3-yl)-N-(2-piperidin-3-ylethyl)propanamide;hydrochloride
CID 119557757
N-(2-piperidin-3-ylethyl)bicyclo[3.1.0]hexane-6-carboxamide
CID 81479536
N-(2-piperidin-3-ylethyl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide
CID 60894986
N-(2-piperidin-3-ylethyl)bicyclo[3.1.0]hexane-6-carboxamide;hydrochloride
CID 119556041
N-(3-cyclopentylpropyl)morpholine-2-carboxamide
CID 113266264
2-cyclopropyl-N-(2-piperidin-3-ylethyl)acetamide
CID 63628201
2,3-dimethyl-N-(2-piperidin-3-ylethyl)butanamide;hydrochloride
CID 119555477
N-[2-(cycloheptylamino)ethyl]-1,4-dioxane-2-carboxamide
CID 81424330

Frequently Asked Questions

What is the IUPAC name of N-(2-piperidin-3-ylethyl)-1,4-dioxane-2-carboxamide?
The IUPAC name of N-(2-piperidin-3-ylethyl)-1,4-dioxane-2-carboxamide (CID 62799919) is N-(2-piperidin-3-ylethyl)-1,4-dioxane-2-carboxamide.
What is the SMILES notation for N-(2-piperidin-3-ylethyl)-1,4-dioxane-2-carboxamide?
The canonical SMILES for N-(2-piperidin-3-ylethyl)-1,4-dioxane-2-carboxamide is O=C(NCCC1CCCNC1)C1COCCO1.
What is the InChIKey of N-(2-piperidin-3-ylethyl)-1,4-dioxane-2-carboxamide?
The InChIKey is WTIJGXXPTFIHFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O3/c15-12(11-9-16-6-7-17-11)14-5-3-10-2-1-4-13-8-10/h10-11,13H,1-9H2,(H,14,15).
What are the key properties of N-(2-piperidin-3-ylethyl)-1,4-dioxane-2-carboxamide?
N-(2-piperidin-3-ylethyl)-1,4-dioxane-2-carboxamide has a molecular weight of 242.32 g/mol, XLogP of -0.09, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-piperidin-3-ylethyl)-1,4-dioxane-2-carboxamide is sourced from PubChem (CID 62799919), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).