3-(2-ethylpiperidin-1-yl)-N-(2-morpholin-4-ylethyl)-3-oxopropanamide

C16H29N3O3 — CID 108944029

IUPAC3-(2-ethylpiperidin-1-yl)-N-(2-morpholin-4-ylethyl)-3-oxopropanamide
SMILESCCC1CCCCN1C(=O)CC(=O)NCCN1CCOCC1
InChIInChI=1S/C16H29N3O3/c1-2-14-5-3-4-7-19(14)16(21)13-15(20)17-6-8-18-9-11-22-12-10-18/h14H,2-13H2,1H3,(H,17,20)
InChIKeyDADHSUWLVGLOFF-UHFFFAOYSA-N
MW311.43 g/mol
LogP0.62
Rot. Bonds6

About 3-(2-ethylpiperidin-1-yl)-N-(2-morpholin-4-ylethyl)-3-oxopropanamide

3-(2-ethylpiperidin-1-yl)-N-(2-morpholin-4-ylethyl)-3-oxopropanamide (PubChem CID 108944029) has the molecular formula C16H29N3O3 and a molecular weight of 311.43 g/mol. Its IUPAC name is 3-(2-ethylpiperidin-1-yl)-N-(2-morpholin-4-ylethyl)-3-oxopropanamide.

Molecular Properties

Compound Name3-(2-ethylpiperidin-1-yl)-N-(2-morpholin-4-ylethyl)-3-oxopropanamide
PubChem CID108944029
Molecular FormulaC16H29N3O3
Molecular Weight311.43 g/mol
Exact Mass311.22
IUPAC Name3-(2-ethylpiperidin-1-yl)-N-(2-morpholin-4-ylethyl)-3-oxopropanamide
SMILESCCC1CCCCN1C(=O)CC(=O)NCCN1CCOCC1
InChIInChI=1S/C16H29N3O3/c1-2-14-5-3-4-7-19(14)16(21)13-15(20)17-6-8-18-9-11-22-12-10-18/h14H,2-13H2,1H3,(H,17,20)
InChIKeyDADHSUWLVGLOFF-UHFFFAOYSA-N
XLogP0.62
TPSA61.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.43
LogP ≤ 50.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}

Analyze 3-(2-ethylpiperidin-1-yl)-N-(2-morpholin-4-ylethyl)-3-oxopropanamide 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

4-(2-ethylpiperidine-1-carbonyl)-N-(2-morpholin-4-ylethyl)cyclohexane-1-carboxamide
CID 109147196
N-butyl-3-(2-ethylpiperidin-1-yl)-3-oxopropanamide
CID 108941432
3-morpholin-4-yl-N-(2-morpholin-4-ylethyl)-3-oxopropanamide
CID 108943424
N-[2-(2-morpholin-4-ylethylamino)-2-oxoethyl]cyclopentanecarboxamide
CID 47178269
N'-cycloheptyl-N-(2-morpholin-4-ylethyl)propanediamide
CID 108944023
3-(4-methylpiperazin-1-yl)-N-(2-morpholin-4-ylethyl)-3-oxopropanamide
CID 108943967
(2-ethylpiperidin-1-yl)-[6-methyl-2-(2-morpholin-4-ylethylamino)pyrimidin-4-yl]methanone
CID 109325229
2-chloro-1-[(2R)-2-ethylpiperidin-1-yl]ethanone
CID 7628883
(2-ethylpiperidin-1-yl)-[2-methyl-6-(2-morpholin-4-ylethylamino)pyrimidin-4-yl]methanone
CID 109366377
1-[(2R)-2-ethylpiperidin-1-yl]propan-1-one
CID 40538705
3-(2-ethylpiperidin-1-yl)-3-oxopropanethioamide
CID 43266603
(1-octadecanoylpiperidin-2-yl)methyl N-(3-morpholin-4-ylpropyl)carbamate
CID 139843228

Frequently Asked Questions

What is the IUPAC name of 3-(2-ethylpiperidin-1-yl)-N-(2-morpholin-4-ylethyl)-3-oxopropanamide?
The IUPAC name of 3-(2-ethylpiperidin-1-yl)-N-(2-morpholin-4-ylethyl)-3-oxopropanamide (CID 108944029) is 3-(2-ethylpiperidin-1-yl)-N-(2-morpholin-4-ylethyl)-3-oxopropanamide.
What is the SMILES notation for 3-(2-ethylpiperidin-1-yl)-N-(2-morpholin-4-ylethyl)-3-oxopropanamide?
The canonical SMILES for 3-(2-ethylpiperidin-1-yl)-N-(2-morpholin-4-ylethyl)-3-oxopropanamide is CCC1CCCCN1C(=O)CC(=O)NCCN1CCOCC1.
What is the InChIKey of 3-(2-ethylpiperidin-1-yl)-N-(2-morpholin-4-ylethyl)-3-oxopropanamide?
The InChIKey is DADHSUWLVGLOFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H29N3O3/c1-2-14-5-3-4-7-19(14)16(21)13-15(20)17-6-8-18-9-11-22-12-10-18/h14H,2-13H2,1H3,(H,17,20).
What are the key properties of 3-(2-ethylpiperidin-1-yl)-N-(2-morpholin-4-ylethyl)-3-oxopropanamide?
3-(2-ethylpiperidin-1-yl)-N-(2-morpholin-4-ylethyl)-3-oxopropanamide has a molecular weight of 311.43 g/mol, XLogP of 0.62, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-ethylpiperidin-1-yl)-N-(2-morpholin-4-ylethyl)-3-oxopropanamide is sourced from PubChem (CID 108944029), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).