N-(3-acetylphenyl)-2-ethoxypyridine-3-carboxamide

C16H16N2O3 — CID 7959021

IUPACN-(3-acetylphenyl)-2-ethoxypyridine-3-carboxamide
SMILESCCOc1ncccc1C(=O)Nc1cccc(C(C)=O)c1
InChIInChI=1S/C16H16N2O3/c1-3-21-16-14(8-5-9-17-16)15(20)18-13-7-4-6-12(10-13)11(2)19/h4-10H,3H2,1-2H3,(H,18,20)
InChIKeyJBKOWAXTNOGTGS-UHFFFAOYSA-N
MW284.32 g/mol
LogP2.94
Rot. Bonds5

About N-(3-acetylphenyl)-2-ethoxypyridine-3-carboxamide

N-(3-acetylphenyl)-2-ethoxypyridine-3-carboxamide (PubChem CID 7959021) has the molecular formula C16H16N2O3 and a molecular weight of 284.32 g/mol. Its IUPAC name is N-(3-acetylphenyl)-2-ethoxypyridine-3-carboxamide.

Molecular Properties

Compound NameN-(3-acetylphenyl)-2-ethoxypyridine-3-carboxamide
PubChem CID7959021
Molecular FormulaC16H16N2O3
Molecular Weight284.32 g/mol
Exact Mass284.12
IUPAC NameN-(3-acetylphenyl)-2-ethoxypyridine-3-carboxamide
SMILESCCOc1ncccc1C(=O)Nc1cccc(C(C)=O)c1
InChIInChI=1S/C16H16N2O3/c1-3-21-16-14(8-5-9-17-16)15(20)18-13-7-4-6-12(10-13)11(2)19/h4-10H,3H2,1-2H3,(H,18,20)
InChIKeyJBKOWAXTNOGTGS-UHFFFAOYSA-N
XLogP2.94
TPSA68.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.32
LogP ≤ 52.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-ethoxy-N-[3-(methylcarbamoyl)phenyl]pyridine-3-carboxamide
CID 17392452
N-(3-acetylphenyl)-2-(2,2,2-trifluoroethoxy)pyridine-3-carboxamide
CID 31884754
2-ethoxy-N-pyridin-3-ylpyridine-3-carboxamide
CID 23876862
N-(3-acetylphenyl)-2-ethoxybenzamide
CID 773754
N-(3-acetylphenyl)-2-methylpyridine-3-carboxamide
CID 78950839
N-(3-acetylphenyl)-2-(propan-2-ylamino)pyridine-3-carboxamide
CID 84574743
N-(2-anilinophenyl)-2-ethoxypyridine-3-carboxamide
CID 44760849
ethyl 2-[(3-acetamidobenzoyl)amino]pyridine-3-carboxylate
CID 110439896
2-ethoxy-N-[3-(6-methylsulfonylpyridazin-3-yl)phenyl]pyridine-3-carboxamide
CID 16799435
2-ethoxy-N-[3-(6-ethylsulfonylpyridazin-3-yl)phenyl]pyridine-3-carboxamide
CID 41213037
N-(3-acetylphenyl)-3-ethoxy-6,7-dimethylquinoxaline-2-carboxamide
CID 50780095
N-(3-acetylphenyl)-2-propoxybenzamide
CID 4947871

Frequently Asked Questions

What is the IUPAC name of N-(3-acetylphenyl)-2-ethoxypyridine-3-carboxamide?
The IUPAC name of N-(3-acetylphenyl)-2-ethoxypyridine-3-carboxamide (CID 7959021) is N-(3-acetylphenyl)-2-ethoxypyridine-3-carboxamide.
What is the SMILES notation for N-(3-acetylphenyl)-2-ethoxypyridine-3-carboxamide?
The canonical SMILES for N-(3-acetylphenyl)-2-ethoxypyridine-3-carboxamide is CCOc1ncccc1C(=O)Nc1cccc(C(C)=O)c1.
What is the InChIKey of N-(3-acetylphenyl)-2-ethoxypyridine-3-carboxamide?
The InChIKey is JBKOWAXTNOGTGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N2O3/c1-3-21-16-14(8-5-9-17-16)15(20)18-13-7-4-6-12(10-13)11(2)19/h4-10H,3H2,1-2H3,(H,18,20).
What are the key properties of N-(3-acetylphenyl)-2-ethoxypyridine-3-carboxamide?
N-(3-acetylphenyl)-2-ethoxypyridine-3-carboxamide has a molecular weight of 284.32 g/mol, XLogP of 2.94, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-acetylphenyl)-2-ethoxypyridine-3-carboxamide is sourced from PubChem (CID 7959021), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).