3-[(4-methylidenepiperidin-1-yl)methyl]morpholine

C11H20N2O — CID 130765910

IUPAC3-[(4-methylidenepiperidin-1-yl)methyl]morpholine
SMILESC=C1CCN(CC2COCCN2)CC1
InChIInChI=1S/C11H20N2O/c1-10-2-5-13(6-3-10)8-11-9-14-7-4-12-11/h11-12H,1-9H2
InChIKeyWQNRMIBQEJNNFV-UHFFFAOYSA-N
MW196.29 g/mol
LogP0.63
Rot. Bonds2

About 3-[(4-methylidenepiperidin-1-yl)methyl]morpholine

3-[(4-methylidenepiperidin-1-yl)methyl]morpholine (PubChem CID 130765910) has the molecular formula C11H20N2O and a molecular weight of 196.29 g/mol. Its IUPAC name is 3-[(4-methylidenepiperidin-1-yl)methyl]morpholine.

Molecular Properties

Compound Name3-[(4-methylidenepiperidin-1-yl)methyl]morpholine
PubChem CID130765910
Molecular FormulaC11H20N2O
Molecular Weight196.29 g/mol
Exact Mass196.16
IUPAC Name3-[(4-methylidenepiperidin-1-yl)methyl]morpholine
SMILESC=C1CCN(CC2COCCN2)CC1
InChIInChI=1S/C11H20N2O/c1-10-2-5-13(6-3-10)8-11-9-14-7-4-12-11/h11-12H,1-9H2
InChIKeyWQNRMIBQEJNNFV-UHFFFAOYSA-N
XLogP0.63
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.29
LogP ≤ 50.63
H-Bond Donors ≤ 51
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 3-[(4-methylidenepiperidin-1-yl)methyl]morpholine?
The IUPAC name of 3-[(4-methylidenepiperidin-1-yl)methyl]morpholine (CID 130765910) is 3-[(4-methylidenepiperidin-1-yl)methyl]morpholine.
What is the SMILES notation for 3-[(4-methylidenepiperidin-1-yl)methyl]morpholine?
The canonical SMILES for 3-[(4-methylidenepiperidin-1-yl)methyl]morpholine is C=C1CCN(CC2COCCN2)CC1.
What is the InChIKey of 3-[(4-methylidenepiperidin-1-yl)methyl]morpholine?
The InChIKey is WQNRMIBQEJNNFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O/c1-10-2-5-13(6-3-10)8-11-9-14-7-4-12-11/h11-12H,1-9H2.
What are the key properties of 3-[(4-methylidenepiperidin-1-yl)methyl]morpholine?
3-[(4-methylidenepiperidin-1-yl)methyl]morpholine has a molecular weight of 196.29 g/mol, XLogP of 0.63, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(4-methylidenepiperidin-1-yl)methyl]morpholine is sourced from PubChem (CID 130765910), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).