4-[2-(piperidin-1-ylmethyl)but-2-enyl]morpholine

C14H26N2O — CID 70025232

IUPAC4-[2-(piperidin-1-ylmethyl)but-2-enyl]morpholine
SMILESCC=C(CN1CCCCC1)CN1CCOCC1
InChIInChI=1S/C14H26N2O/c1-2-14(12-15-6-4-3-5-7-15)13-16-8-10-17-11-9-16/h2H,3-13H2,1H3
InChIKeyWDWMDLUZIRIEQV-UHFFFAOYSA-N
MW238.37 g/mol
LogP1.75
Rot. Bonds4

About 4-[2-(piperidin-1-ylmethyl)but-2-enyl]morpholine

4-[2-(piperidin-1-ylmethyl)but-2-enyl]morpholine (PubChem CID 70025232) has the molecular formula C14H26N2O and a molecular weight of 238.37 g/mol. Its IUPAC name is 4-[2-(piperidin-1-ylmethyl)but-2-enyl]morpholine.

Molecular Properties

Compound Name4-[2-(piperidin-1-ylmethyl)but-2-enyl]morpholine
PubChem CID70025232
Molecular FormulaC14H26N2O
Molecular Weight238.37 g/mol
Exact Mass238.20
IUPAC Name4-[2-(piperidin-1-ylmethyl)but-2-enyl]morpholine
SMILESCC=C(CN1CCCCC1)CN1CCOCC1
InChIInChI=1S/C14H26N2O/c1-2-14(12-15-6-4-3-5-7-15)13-16-8-10-17-11-9-16/h2H,3-13H2,1H3
InChIKeyWDWMDLUZIRIEQV-UHFFFAOYSA-N
XLogP1.75
TPSA15.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.37
LogP ≤ 51.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 4-[2-(piperidin-1-ylmethyl)but-2-enyl]morpholine?
The IUPAC name of 4-[2-(piperidin-1-ylmethyl)but-2-enyl]morpholine (CID 70025232) is 4-[2-(piperidin-1-ylmethyl)but-2-enyl]morpholine.
What is the SMILES notation for 4-[2-(piperidin-1-ylmethyl)but-2-enyl]morpholine?
The canonical SMILES for 4-[2-(piperidin-1-ylmethyl)but-2-enyl]morpholine is CC=C(CN1CCCCC1)CN1CCOCC1.
What is the InChIKey of 4-[2-(piperidin-1-ylmethyl)but-2-enyl]morpholine?
The InChIKey is WDWMDLUZIRIEQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O/c1-2-14(12-15-6-4-3-5-7-15)13-16-8-10-17-11-9-16/h2H,3-13H2,1H3.
What are the key properties of 4-[2-(piperidin-1-ylmethyl)but-2-enyl]morpholine?
4-[2-(piperidin-1-ylmethyl)but-2-enyl]morpholine has a molecular weight of 238.37 g/mol, XLogP of 1.75, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(piperidin-1-ylmethyl)but-2-enyl]morpholine is sourced from PubChem (CID 70025232), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).