(3R)-3-ethyl-1-(2-methoxyethyl)piperidin-4-one

C10H19NO2 — CID 129380797

IUPAC(3R)-3-ethyl-1-(2-methoxyethyl)piperidin-4-one
SMILESCC[C@@H]1CN(CCOC)CCC1=O
InChIInChI=1S/C10H19NO2/c1-3-9-8-11(6-7-13-2)5-4-10(9)12/h9H,3-8H2,1-2H3/t9-/m1/s1
InChIKeySBOHGYNLGXXIHC-SECBINFHSA-N
MW185.27 g/mol
LogP0.93
Rot. Bonds4

About (3R)-3-ethyl-1-(2-methoxyethyl)piperidin-4-one

(3R)-3-ethyl-1-(2-methoxyethyl)piperidin-4-one (PubChem CID 129380797) has the molecular formula C10H19NO2 and a molecular weight of 185.27 g/mol. Its IUPAC name is (3R)-3-ethyl-1-(2-methoxyethyl)piperidin-4-one.

Molecular Properties

Compound Name(3R)-3-ethyl-1-(2-methoxyethyl)piperidin-4-one
PubChem CID129380797
Molecular FormulaC10H19NO2
Molecular Weight185.27 g/mol
Exact Mass185.14
IUPAC Name(3R)-3-ethyl-1-(2-methoxyethyl)piperidin-4-one
SMILESCC[C@@H]1CN(CCOC)CCC1=O
InChIInChI=1S/C10H19NO2/c1-3-9-8-11(6-7-13-2)5-4-10(9)12/h9H,3-8H2,1-2H3/t9-/m1/s1
InChIKeySBOHGYNLGXXIHC-SECBINFHSA-N
XLogP0.93
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.27
LogP ≤ 50.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

3-ethyl-1-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]piperidin-4-one
CID 114508953
3-ethyl-1-[2-(3-methylbutoxy)ethyl]piperidin-4-one
CID 114508865
3-ethyl-1-(2-hydroxyethyl)piperidin-4-one
CID 114508617
3-(3-ethyl-4-oxopiperidin-1-yl)propanoic acid
CID 114509620
methyl 2-(3-ethyl-4-oxopiperidin-1-yl)acetate
CID 114509007
3-ethyl-1-(3-hydroxy-3-methylbutyl)piperidin-4-one
CID 114508829
1-[2-(2-acetylphenoxy)ethyl]-3-ethylpiperidin-4-one
CID 114509724
3-ethyl-1-(2-pyridin-4-ylethyl)piperidin-4-one
CID 114508732
butyl 2-(3-ethyl-4-oxopiperidin-1-yl)acetate
CID 114508947
3-ethyl-1-(2-hydroxybutyl)piperidin-4-one
CID 114508808
3-ethyl-1-[(2-methyltetrazol-5-yl)methyl]piperidin-4-one
CID 107043040
N-ethyl-2-(3-ethyl-4-oxopiperidin-1-yl)-N-methylacetamide
CID 114508729

Frequently Asked Questions

What is the IUPAC name of (3R)-3-ethyl-1-(2-methoxyethyl)piperidin-4-one?
The IUPAC name of (3R)-3-ethyl-1-(2-methoxyethyl)piperidin-4-one (CID 129380797) is (3R)-3-ethyl-1-(2-methoxyethyl)piperidin-4-one.
What is the SMILES notation for (3R)-3-ethyl-1-(2-methoxyethyl)piperidin-4-one?
The canonical SMILES for (3R)-3-ethyl-1-(2-methoxyethyl)piperidin-4-one is CC[C@@H]1CN(CCOC)CCC1=O.
What is the InChIKey of (3R)-3-ethyl-1-(2-methoxyethyl)piperidin-4-one?
The InChIKey is SBOHGYNLGXXIHC-SECBINFHSA-N. The full InChI is InChI=1S/C10H19NO2/c1-3-9-8-11(6-7-13-2)5-4-10(9)12/h9H,3-8H2,1-2H3/t9-/m1/s1.
What are the key properties of (3R)-3-ethyl-1-(2-methoxyethyl)piperidin-4-one?
(3R)-3-ethyl-1-(2-methoxyethyl)piperidin-4-one has a molecular weight of 185.27 g/mol, XLogP of 0.93, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3-ethyl-1-(2-methoxyethyl)piperidin-4-one is sourced from PubChem (CID 129380797), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).