5-[(E)-prop-1-enyl]-1H-pyridin-2-one

C8H9NO — CID 20597917

IUPAC5-[(E)-prop-1-enyl]-1H-pyridin-2-one
SMILESC/C=C/c1ccc(=O)[nH]c1
InChIInChI=1S/C8H9NO/c1-2-3-7-4-5-8(10)9-6-7/h2-6H,1H3,(H,9,10)/b3-2+
InChIKeyWZJNDCABYNVYRO-NSCUHMNNSA-N
MW135.17 g/mol
LogP1.41
Rot. Bonds1

About 5-[(E)-prop-1-enyl]-1H-pyridin-2-one

5-[(E)-prop-1-enyl]-1H-pyridin-2-one (PubChem CID 20597917) has the molecular formula C8H9NO and a molecular weight of 135.17 g/mol. Its IUPAC name is 5-[(E)-prop-1-enyl]-1H-pyridin-2-one.

Molecular Properties

Compound Name5-[(E)-prop-1-enyl]-1H-pyridin-2-one
PubChem CID20597917
Molecular FormulaC8H9NO
Molecular Weight135.17 g/mol
Exact Mass135.07
IUPAC Name5-[(E)-prop-1-enyl]-1H-pyridin-2-one
SMILESC/C=C/c1ccc(=O)[nH]c1
InChIInChI=1S/C8H9NO/c1-2-3-7-4-5-8(10)9-6-7/h2-6H,1H3,(H,9,10)/b3-2+
InChIKeyWZJNDCABYNVYRO-NSCUHMNNSA-N
XLogP1.41
TPSA32.86 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500135.17
LogP ≤ 51.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 5-[(E)-prop-1-enyl]-1H-pyridin-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5-[(E)-prop-1-enyl]-1H-pyridin-2-one?
The IUPAC name of 5-[(E)-prop-1-enyl]-1H-pyridin-2-one (CID 20597917) is 5-[(E)-prop-1-enyl]-1H-pyridin-2-one.
What is the SMILES notation for 5-[(E)-prop-1-enyl]-1H-pyridin-2-one?
The canonical SMILES for 5-[(E)-prop-1-enyl]-1H-pyridin-2-one is C/C=C/c1ccc(=O)[nH]c1.
What is the InChIKey of 5-[(E)-prop-1-enyl]-1H-pyridin-2-one?
The InChIKey is WZJNDCABYNVYRO-NSCUHMNNSA-N. The full InChI is InChI=1S/C8H9NO/c1-2-3-7-4-5-8(10)9-6-7/h2-6H,1H3,(H,9,10)/b3-2+.
What are the key properties of 5-[(E)-prop-1-enyl]-1H-pyridin-2-one?
5-[(E)-prop-1-enyl]-1H-pyridin-2-one has a molecular weight of 135.17 g/mol, XLogP of 1.41, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(E)-prop-1-enyl]-1H-pyridin-2-one is sourced from PubChem (CID 20597917), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).