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

C14H26N2O — CID 18547163

IUPAC4-[(Z)-2-(piperidin-1-ylmethyl)but-2-enyl]morpholine
SMILESC/C=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/b14-2-
InChIKeyWDWMDLUZIRIEQV-VVHNFQOZSA-N
MW238.37 g/mol
LogP1.75
Rot. Bonds4

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

4-[(Z)-2-(piperidin-1-ylmethyl)but-2-enyl]morpholine (PubChem CID 18547163) has the molecular formula C14H26N2O and a molecular weight of 238.37 g/mol. Its IUPAC name is 4-[(Z)-2-(piperidin-1-ylmethyl)but-2-enyl]morpholine.

Molecular Properties

Compound Name4-[(Z)-2-(piperidin-1-ylmethyl)but-2-enyl]morpholine
PubChem CID18547163
Molecular FormulaC14H26N2O
Molecular Weight238.37 g/mol
Exact Mass238.20
IUPAC Name4-[(Z)-2-(piperidin-1-ylmethyl)but-2-enyl]morpholine
SMILESC/C=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/b14-2-
InChIKeyWDWMDLUZIRIEQV-VVHNFQOZSA-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-[(Z)-2-(piperidin-1-ylmethyl)but-2-enyl]morpholine?
The IUPAC name of 4-[(Z)-2-(piperidin-1-ylmethyl)but-2-enyl]morpholine (CID 18547163) is 4-[(Z)-2-(piperidin-1-ylmethyl)but-2-enyl]morpholine.
What is the SMILES notation for 4-[(Z)-2-(piperidin-1-ylmethyl)but-2-enyl]morpholine?
The canonical SMILES for 4-[(Z)-2-(piperidin-1-ylmethyl)but-2-enyl]morpholine is C/C=C(/CN1CCCCC1)CN1CCOCC1.
What is the InChIKey of 4-[(Z)-2-(piperidin-1-ylmethyl)but-2-enyl]morpholine?
The InChIKey is WDWMDLUZIRIEQV-VVHNFQOZSA-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/b14-2-.
What are the key properties of 4-[(Z)-2-(piperidin-1-ylmethyl)but-2-enyl]morpholine?
4-[(Z)-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-[(Z)-2-(piperidin-1-ylmethyl)but-2-enyl]morpholine is sourced from PubChem (CID 18547163), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).