4-(morpholine-4-carbonyl)piperidine-1-carbaldehyde

C11H18N2O3 — CID 57018555

IUPAC4-(morpholine-4-carbonyl)piperidine-1-carbaldehyde
SMILESO=CN1CCC(C(=O)N2CCOCC2)CC1
InChIInChI=1S/C11H18N2O3/c14-9-12-3-1-10(2-4-12)11(15)13-5-7-16-8-6-13/h9-10H,1-8H2
InChIKeyHLRDTPOSOLTTJI-UHFFFAOYSA-N
MW226.28 g/mol
LogP-0.29
Rot. Bonds2

About 4-(morpholine-4-carbonyl)piperidine-1-carbaldehyde

4-(morpholine-4-carbonyl)piperidine-1-carbaldehyde (PubChem CID 57018555) has the molecular formula C11H18N2O3 and a molecular weight of 226.28 g/mol. Its IUPAC name is 4-(morpholine-4-carbonyl)piperidine-1-carbaldehyde.

Molecular Properties

Compound Name4-(morpholine-4-carbonyl)piperidine-1-carbaldehyde
PubChem CID57018555
Molecular FormulaC11H18N2O3
Molecular Weight226.28 g/mol
Exact Mass226.13
IUPAC Name4-(morpholine-4-carbonyl)piperidine-1-carbaldehyde
SMILESO=CN1CCC(C(=O)N2CCOCC2)CC1
InChIInChI=1S/C11H18N2O3/c14-9-12-3-1-10(2-4-12)11(15)13-5-7-16-8-6-13/h9-10H,1-8H2
InChIKeyHLRDTPOSOLTTJI-UHFFFAOYSA-N
XLogP-0.29
TPSA49.85 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.28
LogP ≤ 5-0.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

Analyze 4-(morpholine-4-carbonyl)piperidine-1-carbaldehyde with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-(morpholine-4-carbonyl)piperidine-1-carbaldehyde?
The IUPAC name of 4-(morpholine-4-carbonyl)piperidine-1-carbaldehyde (CID 57018555) is 4-(morpholine-4-carbonyl)piperidine-1-carbaldehyde.
What is the SMILES notation for 4-(morpholine-4-carbonyl)piperidine-1-carbaldehyde?
The canonical SMILES for 4-(morpholine-4-carbonyl)piperidine-1-carbaldehyde is O=CN1CCC(C(=O)N2CCOCC2)CC1.
What is the InChIKey of 4-(morpholine-4-carbonyl)piperidine-1-carbaldehyde?
The InChIKey is HLRDTPOSOLTTJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O3/c14-9-12-3-1-10(2-4-12)11(15)13-5-7-16-8-6-13/h9-10H,1-8H2.
What are the key properties of 4-(morpholine-4-carbonyl)piperidine-1-carbaldehyde?
4-(morpholine-4-carbonyl)piperidine-1-carbaldehyde has a molecular weight of 226.28 g/mol, XLogP of -0.29, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(morpholine-4-carbonyl)piperidine-1-carbaldehyde is sourced from PubChem (CID 57018555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).