N-(5-methylsulfinyl-2-pyridin-2-ylphenyl)acetamide

C14H14N2O2S — CID 57114620

IUPACN-(5-methylsulfinyl-2-pyridin-2-ylphenyl)acetamide
SMILESCC(=O)Nc1cc(S(C)=O)ccc1-c1ccccn1
InChIInChI=1S/C14H14N2O2S/c1-10(17)16-14-9-11(19(2)18)6-7-12(14)13-5-3-4-8-15-13/h3-9H,1-2H3,(H,16,17)
InChIKeyVVFGGIYBHHGOSF-UHFFFAOYSA-N
MW274.35 g/mol
LogP2.44
Rot. Bonds3

About N-(5-methylsulfinyl-2-pyridin-2-ylphenyl)acetamide

N-(5-methylsulfinyl-2-pyridin-2-ylphenyl)acetamide (PubChem CID 57114620) has the molecular formula C14H14N2O2S and a molecular weight of 274.35 g/mol. Its IUPAC name is N-(5-methylsulfinyl-2-pyridin-2-ylphenyl)acetamide.

Molecular Properties

Compound NameN-(5-methylsulfinyl-2-pyridin-2-ylphenyl)acetamide
PubChem CID57114620
Molecular FormulaC14H14N2O2S
Molecular Weight274.35 g/mol
Exact Mass274.08
IUPAC NameN-(5-methylsulfinyl-2-pyridin-2-ylphenyl)acetamide
SMILESCC(=O)Nc1cc(S(C)=O)ccc1-c1ccccn1
InChIInChI=1S/C14H14N2O2S/c1-10(17)16-14-9-11(19(2)18)6-7-12(14)13-5-3-4-8-15-13/h3-9H,1-2H3,(H,16,17)
InChIKeyVVFGGIYBHHGOSF-UHFFFAOYSA-N
XLogP2.44
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.35
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-[3-(4-fluorophenyl)-2-pyridinyl]-5-methylsulfinylphenyl]acetamide
CID 57013438
N-(4-pyridin-2-yl-2-pyridinyl)acetamide
CID 22601790
methanesulfonic acid;N-(4-pyridin-2-yl-3-sulfamoylphenyl)acetamide;hydrate
CID 161208597
N-(3-acetamidoazulen-1-yl)acetamide
CID 86151929
(4-pyridin-2-yl-3-pyridinyl)carbamic acid
CID 118063943
5-methyl-N-phenyl-2-pyridin-2-ylbenzamide
CID 102459618
methyl 3-methyl-4-pyridin-2-ylbenzoate
CID 24829012
N-(4-methylsulfinylphenyl)pyridine-2-carbothioamide
CID 14510237
N-(3-pyridin-2-ylisoquinolin-1-yl)acetamide
CID 14040412
N-[2-hydroxy-5-(2-pyridin-2-yl-1,3-thiazol-4-yl)phenyl]acetamide
CID 135705051
2-phenylpyridine;propan-2-one
CID 174845023
methyl 4-hydroxy-3,5-dipyridin-2-ylbenzoate
CID 135496844

Frequently Asked Questions

What is the IUPAC name of N-(5-methylsulfinyl-2-pyridin-2-ylphenyl)acetamide?
The IUPAC name of N-(5-methylsulfinyl-2-pyridin-2-ylphenyl)acetamide (CID 57114620) is N-(5-methylsulfinyl-2-pyridin-2-ylphenyl)acetamide.
What is the SMILES notation for N-(5-methylsulfinyl-2-pyridin-2-ylphenyl)acetamide?
The canonical SMILES for N-(5-methylsulfinyl-2-pyridin-2-ylphenyl)acetamide is CC(=O)Nc1cc(S(C)=O)ccc1-c1ccccn1.
What is the InChIKey of N-(5-methylsulfinyl-2-pyridin-2-ylphenyl)acetamide?
The InChIKey is VVFGGIYBHHGOSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2O2S/c1-10(17)16-14-9-11(19(2)18)6-7-12(14)13-5-3-4-8-15-13/h3-9H,1-2H3,(H,16,17).
What are the key properties of N-(5-methylsulfinyl-2-pyridin-2-ylphenyl)acetamide?
N-(5-methylsulfinyl-2-pyridin-2-ylphenyl)acetamide has a molecular weight of 274.35 g/mol, XLogP of 2.44, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-methylsulfinyl-2-pyridin-2-ylphenyl)acetamide is sourced from PubChem (CID 57114620), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).