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

C11H18N2O3 — CID 54109336

IUPAC2-(piperidine-1-carbonyl)morpholine-4-carbaldehyde
SMILESO=CN1CCOC(C(=O)N2CCCCC2)C1
InChIInChI=1S/C11H18N2O3/c14-9-12-6-7-16-10(8-12)11(15)13-4-2-1-3-5-13/h9-10H,1-8H2
InChIKeyBFMAPHFPFAWINE-UHFFFAOYSA-N
MW226.28 g/mol
LogP-0.14
Rot. Bonds2

About 2-(piperidine-1-carbonyl)morpholine-4-carbaldehyde

2-(piperidine-1-carbonyl)morpholine-4-carbaldehyde (PubChem CID 54109336) has the molecular formula C11H18N2O3 and a molecular weight of 226.28 g/mol. Its IUPAC name is 2-(piperidine-1-carbonyl)morpholine-4-carbaldehyde.

Molecular Properties

Compound Name2-(piperidine-1-carbonyl)morpholine-4-carbaldehyde
PubChem CID54109336
Molecular FormulaC11H18N2O3
Molecular Weight226.28 g/mol
Exact Mass226.13
IUPAC Name2-(piperidine-1-carbonyl)morpholine-4-carbaldehyde
SMILESO=CN1CCOC(C(=O)N2CCCCC2)C1
InChIInChI=1S/C11H18N2O3/c14-9-12-6-7-16-10(8-12)11(15)13-4-2-1-3-5-13/h9-10H,1-8H2
InChIKeyBFMAPHFPFAWINE-UHFFFAOYSA-N
XLogP-0.14
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 ≤ 5-0.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-(piperidine-1-carbonyl)morpholine-4-carbaldehyde?
The IUPAC name of 2-(piperidine-1-carbonyl)morpholine-4-carbaldehyde (CID 54109336) is 2-(piperidine-1-carbonyl)morpholine-4-carbaldehyde.
What is the SMILES notation for 2-(piperidine-1-carbonyl)morpholine-4-carbaldehyde?
The canonical SMILES for 2-(piperidine-1-carbonyl)morpholine-4-carbaldehyde is O=CN1CCOC(C(=O)N2CCCCC2)C1.
What is the InChIKey of 2-(piperidine-1-carbonyl)morpholine-4-carbaldehyde?
The InChIKey is BFMAPHFPFAWINE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O3/c14-9-12-6-7-16-10(8-12)11(15)13-4-2-1-3-5-13/h9-10H,1-8H2.
What are the key properties of 2-(piperidine-1-carbonyl)morpholine-4-carbaldehyde?
2-(piperidine-1-carbonyl)morpholine-4-carbaldehyde has a molecular weight of 226.28 g/mol, XLogP of -0.14, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(piperidine-1-carbonyl)morpholine-4-carbaldehyde is sourced from PubChem (CID 54109336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).