N-[4-(pyridin-2-ylcarbamoylamino)phenyl]sulfonylacetamide

C14H14N4O4S — CID 110492034

IUPACN-[4-(pyridin-2-ylcarbamoylamino)phenyl]sulfonylacetamide
SMILESCC(=O)NS(=O)(=O)c1ccc(NC(=O)Nc2ccccn2)cc1
InChIInChI=1S/C14H14N4O4S/c1-10(19)18-23(21,22)12-7-5-11(6-8-12)16-14(20)17-13-4-2-3-9-15-13/h2-9H,1H3,(H,18,19)(H2,15,16,17,20)
InChIKeySOWCVVUZVOVMFY-UHFFFAOYSA-N
MW334.36 g/mol
LogP1.55
Rot. Bonds4

About N-[4-(pyridin-2-ylcarbamoylamino)phenyl]sulfonylacetamide

N-[4-(pyridin-2-ylcarbamoylamino)phenyl]sulfonylacetamide (PubChem CID 110492034) has the molecular formula C14H14N4O4S and a molecular weight of 334.36 g/mol. Its IUPAC name is N-[4-(pyridin-2-ylcarbamoylamino)phenyl]sulfonylacetamide.

Molecular Properties

Compound NameN-[4-(pyridin-2-ylcarbamoylamino)phenyl]sulfonylacetamide
PubChem CID110492034
Molecular FormulaC14H14N4O4S
Molecular Weight334.36 g/mol
Exact Mass334.07
IUPAC NameN-[4-(pyridin-2-ylcarbamoylamino)phenyl]sulfonylacetamide
SMILESCC(=O)NS(=O)(=O)c1ccc(NC(=O)Nc2ccccn2)cc1
InChIInChI=1S/C14H14N4O4S/c1-10(19)18-23(21,22)12-7-5-11(6-8-12)16-14(20)17-13-4-2-3-9-15-13/h2-9H,1H3,(H,18,19)(H2,15,16,17,20)
InChIKeySOWCVVUZVOVMFY-UHFFFAOYSA-N
XLogP1.55
TPSA117.26 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.36
LogP ≤ 51.55
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

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N-[4-(acetylsulfamoyl)phenyl]-5-methyl-1-pyridin-2-ylpyrazole-4-carboxamide
CID 108793466
2-chloro-N-[4-(pyridin-2-ylsulfamoyl)phenyl]propanamide
CID 71300028
N-[4-(acetylsulfamoyl)phenyl]-2,2-diphenylacetamide
CID 2422278
N-[4-(acetylsulfamoyl)phenyl]-2-methoxybenzamide
CID 803307
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Frequently Asked Questions

What is the IUPAC name of N-[4-(pyridin-2-ylcarbamoylamino)phenyl]sulfonylacetamide?
The IUPAC name of N-[4-(pyridin-2-ylcarbamoylamino)phenyl]sulfonylacetamide (CID 110492034) is N-[4-(pyridin-2-ylcarbamoylamino)phenyl]sulfonylacetamide.
What is the SMILES notation for N-[4-(pyridin-2-ylcarbamoylamino)phenyl]sulfonylacetamide?
The canonical SMILES for N-[4-(pyridin-2-ylcarbamoylamino)phenyl]sulfonylacetamide is CC(=O)NS(=O)(=O)c1ccc(NC(=O)Nc2ccccn2)cc1.
What is the InChIKey of N-[4-(pyridin-2-ylcarbamoylamino)phenyl]sulfonylacetamide?
The InChIKey is SOWCVVUZVOVMFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N4O4S/c1-10(19)18-23(21,22)12-7-5-11(6-8-12)16-14(20)17-13-4-2-3-9-15-13/h2-9H,1H3,(H,18,19)(H2,15,16,17,20).
What are the key properties of N-[4-(pyridin-2-ylcarbamoylamino)phenyl]sulfonylacetamide?
N-[4-(pyridin-2-ylcarbamoylamino)phenyl]sulfonylacetamide has a molecular weight of 334.36 g/mol, XLogP of 1.55, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(pyridin-2-ylcarbamoylamino)phenyl]sulfonylacetamide is sourced from PubChem (CID 110492034), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).