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

C11H18N2O — CID 116622320

IUPAC1-[2-(diethylamino)ethyl]pyridin-4-one
SMILESCCN(CC)CCn1ccc(=O)cc1
InChIInChI=1S/C11H18N2O/c1-3-12(4-2)9-10-13-7-5-11(14)6-8-13/h5-8H,3-4,9-10H2,1-2H3
InChIKeyRVKFAFNTBFFDER-UHFFFAOYSA-N
MW194.28 g/mol
LogP1.19
Rot. Bonds5

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

1-[2-(diethylamino)ethyl]pyridin-4-one (PubChem CID 116622320) has the molecular formula C11H18N2O and a molecular weight of 194.28 g/mol. Its IUPAC name is 1-[2-(diethylamino)ethyl]pyridin-4-one.

Molecular Properties

Compound Name1-[2-(diethylamino)ethyl]pyridin-4-one
PubChem CID116622320
Molecular FormulaC11H18N2O
Molecular Weight194.28 g/mol
Exact Mass194.14
IUPAC Name1-[2-(diethylamino)ethyl]pyridin-4-one
SMILESCCN(CC)CCn1ccc(=O)cc1
InChIInChI=1S/C11H18N2O/c1-3-12(4-2)9-10-13-7-5-11(14)6-8-13/h5-8H,3-4,9-10H2,1-2H3
InChIKeyRVKFAFNTBFFDER-UHFFFAOYSA-N
XLogP1.19
TPSA25.24 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.28
LogP ≤ 51.19
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]pyridin-4-one?
The IUPAC name of 1-[2-(diethylamino)ethyl]pyridin-4-one (CID 116622320) is 1-[2-(diethylamino)ethyl]pyridin-4-one.
What is the SMILES notation for 1-[2-(diethylamino)ethyl]pyridin-4-one?
The canonical SMILES for 1-[2-(diethylamino)ethyl]pyridin-4-one is CCN(CC)CCn1ccc(=O)cc1.
What is the InChIKey of 1-[2-(diethylamino)ethyl]pyridin-4-one?
The InChIKey is RVKFAFNTBFFDER-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O/c1-3-12(4-2)9-10-13-7-5-11(14)6-8-13/h5-8H,3-4,9-10H2,1-2H3.
What are the key properties of 1-[2-(diethylamino)ethyl]pyridin-4-one?
1-[2-(diethylamino)ethyl]pyridin-4-one has a molecular weight of 194.28 g/mol, XLogP of 1.19, 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]pyridin-4-one is sourced from PubChem (CID 116622320), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).