1-[1-(2-ethenylphenoxy)ethyl]piperidin-2-one

C15H19NO2 — CID 70232345

IUPAC1-[1-(2-ethenylphenoxy)ethyl]piperidin-2-one
SMILESC=Cc1ccccc1OC(C)N1CCCCC1=O
InChIInChI=1S/C15H19NO2/c1-3-13-8-4-5-9-14(13)18-12(2)16-11-7-6-10-15(16)17/h3-5,8-9,12H,1,6-7,10-11H2,2H3
InChIKeyKUERSVUQRYJRPF-UHFFFAOYSA-N
MW245.32 g/mol
LogP3.07
Rot. Bonds4

About 1-[1-(2-ethenylphenoxy)ethyl]piperidin-2-one

1-[1-(2-ethenylphenoxy)ethyl]piperidin-2-one (PubChem CID 70232345) has the molecular formula C15H19NO2 and a molecular weight of 245.32 g/mol. Its IUPAC name is 1-[1-(2-ethenylphenoxy)ethyl]piperidin-2-one.

Molecular Properties

Compound Name1-[1-(2-ethenylphenoxy)ethyl]piperidin-2-one
PubChem CID70232345
Molecular FormulaC15H19NO2
Molecular Weight245.32 g/mol
Exact Mass245.14
IUPAC Name1-[1-(2-ethenylphenoxy)ethyl]piperidin-2-one
SMILESC=Cc1ccccc1OC(C)N1CCCCC1=O
InChIInChI=1S/C15H19NO2/c1-3-13-8-4-5-9-14(13)18-12(2)16-11-7-6-10-15(16)17/h3-5,8-9,12H,1,6-7,10-11H2,2H3
InChIKeyKUERSVUQRYJRPF-UHFFFAOYSA-N
XLogP3.07
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.32
LogP ≤ 53.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-[1-(2-ethenylphenoxy)ethyl]piperidin-2-one?
The IUPAC name of 1-[1-(2-ethenylphenoxy)ethyl]piperidin-2-one (CID 70232345) is 1-[1-(2-ethenylphenoxy)ethyl]piperidin-2-one.
What is the SMILES notation for 1-[1-(2-ethenylphenoxy)ethyl]piperidin-2-one?
The canonical SMILES for 1-[1-(2-ethenylphenoxy)ethyl]piperidin-2-one is C=Cc1ccccc1OC(C)N1CCCCC1=O.
What is the InChIKey of 1-[1-(2-ethenylphenoxy)ethyl]piperidin-2-one?
The InChIKey is KUERSVUQRYJRPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19NO2/c1-3-13-8-4-5-9-14(13)18-12(2)16-11-7-6-10-15(16)17/h3-5,8-9,12H,1,6-7,10-11H2,2H3.
What are the key properties of 1-[1-(2-ethenylphenoxy)ethyl]piperidin-2-one?
1-[1-(2-ethenylphenoxy)ethyl]piperidin-2-one has a molecular weight of 245.32 g/mol, XLogP of 3.07, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(2-ethenylphenoxy)ethyl]piperidin-2-one is sourced from PubChem (CID 70232345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).