2-[1-(2-methoxyethyl)piperidin-2-yl]cyclohexan-1-one

C14H25NO2 — CID 79553024

IUPAC2-[1-(2-methoxyethyl)piperidin-2-yl]cyclohexan-1-one
SMILESCOCCN1CCCCC1C1CCCCC1=O
InChIInChI=1S/C14H25NO2/c1-17-11-10-15-9-5-4-7-13(15)12-6-2-3-8-14(12)16/h12-13H,2-11H2,1H3
InChIKeyCTWPWBAJCXLFCX-UHFFFAOYSA-N
MW239.36 g/mol
LogP2.25
Rot. Bonds4

About 2-[1-(2-methoxyethyl)piperidin-2-yl]cyclohexan-1-one

2-[1-(2-methoxyethyl)piperidin-2-yl]cyclohexan-1-one (PubChem CID 79553024) has the molecular formula C14H25NO2 and a molecular weight of 239.36 g/mol. Its IUPAC name is 2-[1-(2-methoxyethyl)piperidin-2-yl]cyclohexan-1-one.

Molecular Properties

Compound Name2-[1-(2-methoxyethyl)piperidin-2-yl]cyclohexan-1-one
PubChem CID79553024
Molecular FormulaC14H25NO2
Molecular Weight239.36 g/mol
Exact Mass239.19
IUPAC Name2-[1-(2-methoxyethyl)piperidin-2-yl]cyclohexan-1-one
SMILESCOCCN1CCCCC1C1CCCCC1=O
InChIInChI=1S/C14H25NO2/c1-17-11-10-15-9-5-4-7-13(15)12-6-2-3-8-14(12)16/h12-13H,2-11H2,1H3
InChIKeyCTWPWBAJCXLFCX-UHFFFAOYSA-N
XLogP2.25
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.36
LogP ≤ 52.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[1-(2-methoxyethyl)piperidin-2-yl]cyclohexan-1-one?
The IUPAC name of 2-[1-(2-methoxyethyl)piperidin-2-yl]cyclohexan-1-one (CID 79553024) is 2-[1-(2-methoxyethyl)piperidin-2-yl]cyclohexan-1-one.
What is the SMILES notation for 2-[1-(2-methoxyethyl)piperidin-2-yl]cyclohexan-1-one?
The canonical SMILES for 2-[1-(2-methoxyethyl)piperidin-2-yl]cyclohexan-1-one is COCCN1CCCCC1C1CCCCC1=O.
What is the InChIKey of 2-[1-(2-methoxyethyl)piperidin-2-yl]cyclohexan-1-one?
The InChIKey is CTWPWBAJCXLFCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25NO2/c1-17-11-10-15-9-5-4-7-13(15)12-6-2-3-8-14(12)16/h12-13H,2-11H2,1H3.
What are the key properties of 2-[1-(2-methoxyethyl)piperidin-2-yl]cyclohexan-1-one?
2-[1-(2-methoxyethyl)piperidin-2-yl]cyclohexan-1-one has a molecular weight of 239.36 g/mol, XLogP of 2.25, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(2-methoxyethyl)piperidin-2-yl]cyclohexan-1-one is sourced from PubChem (CID 79553024), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).