3-(3-acetylphenyl)-5-anilino-1H-pyridin-2-one

C19H16N2O2 — CID 156717148

IUPAC3-(3-acetylphenyl)-5-anilino-1H-pyridin-2-one
SMILESCC(=O)c1cccc(-c2cc(Nc3ccccc3)c[nH]c2=O)c1
InChIInChI=1S/C19H16N2O2/c1-13(22)14-6-5-7-15(10-14)18-11-17(12-20-19(18)23)21-16-8-3-2-4-9-16/h2-12,21H,1H3,(H,20,23)
InChIKeyICZSSAJKEIWZSO-UHFFFAOYSA-N
MW304.35 g/mol
LogP3.99
Rot. Bonds4

About 3-(3-acetylphenyl)-5-anilino-1H-pyridin-2-one

3-(3-acetylphenyl)-5-anilino-1H-pyridin-2-one (PubChem CID 156717148) has the molecular formula C19H16N2O2 and a molecular weight of 304.35 g/mol. Its IUPAC name is 3-(3-acetylphenyl)-5-anilino-1H-pyridin-2-one.

Molecular Properties

Compound Name3-(3-acetylphenyl)-5-anilino-1H-pyridin-2-one
PubChem CID156717148
Molecular FormulaC19H16N2O2
Molecular Weight304.35 g/mol
Exact Mass304.12
IUPAC Name3-(3-acetylphenyl)-5-anilino-1H-pyridin-2-one
SMILESCC(=O)c1cccc(-c2cc(Nc3ccccc3)c[nH]c2=O)c1
InChIInChI=1S/C19H16N2O2/c1-13(22)14-6-5-7-15(10-14)18-11-17(12-20-19(18)23)21-16-8-3-2-4-9-16/h2-12,21H,1H3,(H,20,23)
InChIKeyICZSSAJKEIWZSO-UHFFFAOYSA-N
XLogP3.99
TPSA61.96 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.35
LogP ≤ 53.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-(3-acetylphenyl)-5-anilino-1H-pyridin-2-one?
The IUPAC name of 3-(3-acetylphenyl)-5-anilino-1H-pyridin-2-one (CID 156717148) is 3-(3-acetylphenyl)-5-anilino-1H-pyridin-2-one.
What is the SMILES notation for 3-(3-acetylphenyl)-5-anilino-1H-pyridin-2-one?
The canonical SMILES for 3-(3-acetylphenyl)-5-anilino-1H-pyridin-2-one is CC(=O)c1cccc(-c2cc(Nc3ccccc3)c[nH]c2=O)c1.
What is the InChIKey of 3-(3-acetylphenyl)-5-anilino-1H-pyridin-2-one?
The InChIKey is ICZSSAJKEIWZSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16N2O2/c1-13(22)14-6-5-7-15(10-14)18-11-17(12-20-19(18)23)21-16-8-3-2-4-9-16/h2-12,21H,1H3,(H,20,23).
What are the key properties of 3-(3-acetylphenyl)-5-anilino-1H-pyridin-2-one?
3-(3-acetylphenyl)-5-anilino-1H-pyridin-2-one has a molecular weight of 304.35 g/mol, XLogP of 3.99, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-acetylphenyl)-5-anilino-1H-pyridin-2-one is sourced from PubChem (CID 156717148), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).