N-[3-(pyridin-3-ylsulfonylamino)phenyl]acetamide

C13H13N3O3S — CID 110865862

IUPACN-[3-(pyridin-3-ylsulfonylamino)phenyl]acetamide
SMILESCC(=O)Nc1cccc(NS(=O)(=O)c2cccnc2)c1
InChIInChI=1S/C13H13N3O3S/c1-10(17)15-11-4-2-5-12(8-11)16-20(18,19)13-6-3-7-14-9-13/h2-9,16H,1H3,(H,15,17)
InChIKeyAZXQFFFFVPHSLR-UHFFFAOYSA-N
MW291.33 g/mol
LogP1.84
Rot. Bonds4

About N-[3-(pyridin-3-ylsulfonylamino)phenyl]acetamide

N-[3-(pyridin-3-ylsulfonylamino)phenyl]acetamide (PubChem CID 110865862) has the molecular formula C13H13N3O3S and a molecular weight of 291.33 g/mol. Its IUPAC name is N-[3-(pyridin-3-ylsulfonylamino)phenyl]acetamide.

Molecular Properties

Compound NameN-[3-(pyridin-3-ylsulfonylamino)phenyl]acetamide
PubChem CID110865862
Molecular FormulaC13H13N3O3S
Molecular Weight291.33 g/mol
Exact Mass291.07
IUPAC NameN-[3-(pyridin-3-ylsulfonylamino)phenyl]acetamide
SMILESCC(=O)Nc1cccc(NS(=O)(=O)c2cccnc2)c1
InChIInChI=1S/C13H13N3O3S/c1-10(17)15-11-4-2-5-12(8-11)16-20(18,19)13-6-3-7-14-9-13/h2-9,16H,1H3,(H,15,17)
InChIKeyAZXQFFFFVPHSLR-UHFFFAOYSA-N
XLogP1.84
TPSA88.16 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.33
LogP ≤ 51.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[3-(pyridin-3-ylsulfonylamino)phenyl]acetamide?
The IUPAC name of N-[3-(pyridin-3-ylsulfonylamino)phenyl]acetamide (CID 110865862) is N-[3-(pyridin-3-ylsulfonylamino)phenyl]acetamide.
What is the SMILES notation for N-[3-(pyridin-3-ylsulfonylamino)phenyl]acetamide?
The canonical SMILES for N-[3-(pyridin-3-ylsulfonylamino)phenyl]acetamide is CC(=O)Nc1cccc(NS(=O)(=O)c2cccnc2)c1.
What is the InChIKey of N-[3-(pyridin-3-ylsulfonylamino)phenyl]acetamide?
The InChIKey is AZXQFFFFVPHSLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13N3O3S/c1-10(17)15-11-4-2-5-12(8-11)16-20(18,19)13-6-3-7-14-9-13/h2-9,16H,1H3,(H,15,17).
What are the key properties of N-[3-(pyridin-3-ylsulfonylamino)phenyl]acetamide?
N-[3-(pyridin-3-ylsulfonylamino)phenyl]acetamide has a molecular weight of 291.33 g/mol, XLogP of 1.84, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(pyridin-3-ylsulfonylamino)phenyl]acetamide is sourced from PubChem (CID 110865862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).