4-[[1-[(3-methoxypiperidin-1-yl)methyl]cyclohexyl]methyl]morpholine

C18H34N2O2 — CID 84592709

IUPAC4-[[1-[(3-methoxypiperidin-1-yl)methyl]cyclohexyl]methyl]morpholine
SMILESCOC1CCCN(CC2(CN3CCOCC3)CCCCC2)C1
InChIInChI=1S/C18H34N2O2/c1-21-17-6-5-9-20(14-17)16-18(7-3-2-4-8-18)15-19-10-12-22-13-11-19/h17H,2-16H2,1H3
InChIKeyYXRSDWPSKPASAN-UHFFFAOYSA-N
MW310.48 g/mol
LogP2.38
Rot. Bonds5

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

4-[[1-[(3-methoxypiperidin-1-yl)methyl]cyclohexyl]methyl]morpholine (PubChem CID 84592709) has the molecular formula C18H34N2O2 and a molecular weight of 310.48 g/mol. Its IUPAC name is 4-[[1-[(3-methoxypiperidin-1-yl)methyl]cyclohexyl]methyl]morpholine.

Molecular Properties

Compound Name4-[[1-[(3-methoxypiperidin-1-yl)methyl]cyclohexyl]methyl]morpholine
PubChem CID84592709
Molecular FormulaC18H34N2O2
Molecular Weight310.48 g/mol
Exact Mass310.26
IUPAC Name4-[[1-[(3-methoxypiperidin-1-yl)methyl]cyclohexyl]methyl]morpholine
SMILESCOC1CCCN(CC2(CN3CCOCC3)CCCCC2)C1
InChIInChI=1S/C18H34N2O2/c1-21-17-6-5-9-20(14-17)16-18(7-3-2-4-8-18)15-19-10-12-22-13-11-19/h17H,2-16H2,1H3
InChIKeyYXRSDWPSKPASAN-UHFFFAOYSA-N
XLogP2.38
TPSA24.94 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.48
LogP ≤ 52.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-[[1-[(3-methoxypiperidin-1-yl)methyl]cyclohexyl]methyl]morpholine?
The IUPAC name of 4-[[1-[(3-methoxypiperidin-1-yl)methyl]cyclohexyl]methyl]morpholine (CID 84592709) is 4-[[1-[(3-methoxypiperidin-1-yl)methyl]cyclohexyl]methyl]morpholine.
What is the SMILES notation for 4-[[1-[(3-methoxypiperidin-1-yl)methyl]cyclohexyl]methyl]morpholine?
The canonical SMILES for 4-[[1-[(3-methoxypiperidin-1-yl)methyl]cyclohexyl]methyl]morpholine is COC1CCCN(CC2(CN3CCOCC3)CCCCC2)C1.
What is the InChIKey of 4-[[1-[(3-methoxypiperidin-1-yl)methyl]cyclohexyl]methyl]morpholine?
The InChIKey is YXRSDWPSKPASAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H34N2O2/c1-21-17-6-5-9-20(14-17)16-18(7-3-2-4-8-18)15-19-10-12-22-13-11-19/h17H,2-16H2,1H3.
What are the key properties of 4-[[1-[(3-methoxypiperidin-1-yl)methyl]cyclohexyl]methyl]morpholine?
4-[[1-[(3-methoxypiperidin-1-yl)methyl]cyclohexyl]methyl]morpholine has a molecular weight of 310.48 g/mol, XLogP of 2.38, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[1-[(3-methoxypiperidin-1-yl)methyl]cyclohexyl]methyl]morpholine is sourced from PubChem (CID 84592709), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).