6-ethyl-1-(2-hydroxyethyl)-5-pyridin-4-ylpyridin-2-one

C14H16N2O2 — CID 20515007

IUPAC6-ethyl-1-(2-hydroxyethyl)-5-pyridin-4-ylpyridin-2-one
SMILESCCc1c(-c2ccncc2)ccc(=O)n1CCO
InChIInChI=1S/C14H16N2O2/c1-2-13-12(11-5-7-15-8-6-11)3-4-14(18)16(13)9-10-17/h3-8,17H,2,9-10H2,1H3
InChIKeyXYSQHYJZWKXWEO-UHFFFAOYSA-N
MW244.29 g/mol
LogP1.47
Rot. Bonds4

About 6-ethyl-1-(2-hydroxyethyl)-5-pyridin-4-ylpyridin-2-one

6-ethyl-1-(2-hydroxyethyl)-5-pyridin-4-ylpyridin-2-one (PubChem CID 20515007) has the molecular formula C14H16N2O2 and a molecular weight of 244.29 g/mol. Its IUPAC name is 6-ethyl-1-(2-hydroxyethyl)-5-pyridin-4-ylpyridin-2-one.

Molecular Properties

Compound Name6-ethyl-1-(2-hydroxyethyl)-5-pyridin-4-ylpyridin-2-one
PubChem CID20515007
Molecular FormulaC14H16N2O2
Molecular Weight244.29 g/mol
Exact Mass244.12
IUPAC Name6-ethyl-1-(2-hydroxyethyl)-5-pyridin-4-ylpyridin-2-one
SMILESCCc1c(-c2ccncc2)ccc(=O)n1CCO
InChIInChI=1S/C14H16N2O2/c1-2-13-12(11-5-7-15-8-6-11)3-4-14(18)16(13)9-10-17/h3-8,17H,2,9-10H2,1H3
InChIKeyXYSQHYJZWKXWEO-UHFFFAOYSA-N
XLogP1.47
TPSA55.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.29
LogP ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-ethyl-1-(2-hydroxyethyl)-5-pyridin-4-ylpyridin-2-one?
The IUPAC name of 6-ethyl-1-(2-hydroxyethyl)-5-pyridin-4-ylpyridin-2-one (CID 20515007) is 6-ethyl-1-(2-hydroxyethyl)-5-pyridin-4-ylpyridin-2-one.
What is the SMILES notation for 6-ethyl-1-(2-hydroxyethyl)-5-pyridin-4-ylpyridin-2-one?
The canonical SMILES for 6-ethyl-1-(2-hydroxyethyl)-5-pyridin-4-ylpyridin-2-one is CCc1c(-c2ccncc2)ccc(=O)n1CCO.
What is the InChIKey of 6-ethyl-1-(2-hydroxyethyl)-5-pyridin-4-ylpyridin-2-one?
The InChIKey is XYSQHYJZWKXWEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O2/c1-2-13-12(11-5-7-15-8-6-11)3-4-14(18)16(13)9-10-17/h3-8,17H,2,9-10H2,1H3.
What are the key properties of 6-ethyl-1-(2-hydroxyethyl)-5-pyridin-4-ylpyridin-2-one?
6-ethyl-1-(2-hydroxyethyl)-5-pyridin-4-ylpyridin-2-one has a molecular weight of 244.29 g/mol, XLogP of 1.47, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-1-(2-hydroxyethyl)-5-pyridin-4-ylpyridin-2-one is sourced from PubChem (CID 20515007), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).