1-[2-(diethylamino)ethyl]piperidin-4-one

C11H22N2O — CID 10420281

IUPAC1-[2-(diethylamino)ethyl]piperidin-4-one
SMILESCCN(CC)CCN1CCC(=O)CC1
InChIInChI=1S/C11H22N2O/c1-3-12(4-2)9-10-13-7-5-11(14)6-8-13/h3-10H2,1-2H3
InChIKeyZWNUQKCJZCIKFO-UHFFFAOYSA-N
MW198.31 g/mol
LogP0.99
Rot. Bonds5

About 1-[2-(diethylamino)ethyl]piperidin-4-one

1-[2-(diethylamino)ethyl]piperidin-4-one (PubChem CID 10420281) has the molecular formula C11H22N2O and a molecular weight of 198.31 g/mol. Its IUPAC name is 1-[2-(diethylamino)ethyl]piperidin-4-one.

Molecular Properties

Compound Name1-[2-(diethylamino)ethyl]piperidin-4-one
PubChem CID10420281
Molecular FormulaC11H22N2O
Molecular Weight198.31 g/mol
Exact Mass198.17
IUPAC Name1-[2-(diethylamino)ethyl]piperidin-4-one
SMILESCCN(CC)CCN1CCC(=O)CC1
InChIInChI=1S/C11H22N2O/c1-3-12(4-2)9-10-13-7-5-11(14)6-8-13/h3-10H2,1-2H3
InChIKeyZWNUQKCJZCIKFO-UHFFFAOYSA-N
XLogP0.99
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.31
LogP ≤ 50.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-[2-(diethylamino)ethyl]piperidin-4-one?
The IUPAC name of 1-[2-(diethylamino)ethyl]piperidin-4-one (CID 10420281) is 1-[2-(diethylamino)ethyl]piperidin-4-one.
What is the SMILES notation for 1-[2-(diethylamino)ethyl]piperidin-4-one?
The canonical SMILES for 1-[2-(diethylamino)ethyl]piperidin-4-one is CCN(CC)CCN1CCC(=O)CC1.
What is the InChIKey of 1-[2-(diethylamino)ethyl]piperidin-4-one?
The InChIKey is ZWNUQKCJZCIKFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O/c1-3-12(4-2)9-10-13-7-5-11(14)6-8-13/h3-10H2,1-2H3.
What are the key properties of 1-[2-(diethylamino)ethyl]piperidin-4-one?
1-[2-(diethylamino)ethyl]piperidin-4-one has a molecular weight of 198.31 g/mol, XLogP of 0.99, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(diethylamino)ethyl]piperidin-4-one is sourced from PubChem (CID 10420281), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).