2-pyridin-4-yl-N-(4-sulfamoylphenyl)acetamide

C13H13N3O3S — CID 44520904

IUPAC2-pyridin-4-yl-N-(4-sulfamoylphenyl)acetamide
SMILESNS(=O)(=O)c1ccc(NC(=O)Cc2ccncc2)cc1
InChIInChI=1S/C13H13N3O3S/c14-20(18,19)12-3-1-11(2-4-12)16-13(17)9-10-5-7-15-8-6-10/h1-8H,9H2,(H,16,17)(H2,14,18,19)
InChIKeyCXBVXOMVANONBT-UHFFFAOYSA-N
MW291.33 g/mol
LogP0.91
Rot. Bonds4

About 2-pyridin-4-yl-N-(4-sulfamoylphenyl)acetamide

2-pyridin-4-yl-N-(4-sulfamoylphenyl)acetamide (PubChem CID 44520904) has the molecular formula C13H13N3O3S and a molecular weight of 291.33 g/mol. Its IUPAC name is 2-pyridin-4-yl-N-(4-sulfamoylphenyl)acetamide.

Molecular Properties

Compound Name2-pyridin-4-yl-N-(4-sulfamoylphenyl)acetamide
PubChem CID44520904
Molecular FormulaC13H13N3O3S
Molecular Weight291.33 g/mol
Exact Mass291.07
IUPAC Name2-pyridin-4-yl-N-(4-sulfamoylphenyl)acetamide
SMILESNS(=O)(=O)c1ccc(NC(=O)Cc2ccncc2)cc1
InChIInChI=1S/C13H13N3O3S/c14-20(18,19)12-3-1-11(2-4-12)16-13(17)9-10-5-7-15-8-6-10/h1-8H,9H2,(H,16,17)(H2,14,18,19)
InChIKeyCXBVXOMVANONBT-UHFFFAOYSA-N
XLogP0.91
TPSA102.15 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 ≤ 50.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

Acetylsulfapyridine
CID 58638
N'-isonicotinoylbenzenesulfonohydrazide
CID 468603
(1s,2s)-N-[4-(Phenylsulfonyl)phenyl]-2-(Pyridin-3-Yl)cyclopropanecarboxamide
CID 71720911
N-(3-pyridyl)[3-(pyrrolidinylsulfonyl)phenyl]carboxamide
CID 711634
N-(4-{[2-(pyridin-3-yl)piperidin-1-yl]sulfonyl}phenyl)acetamide
CID 659759
N-(4-{[(pyridin-4-yl)methyl]sulfamoyl}phenyl)acetamide
CID 720106
Sulfonamide deriv., 7g
CID 44520903
Sulfonamide deriv., 7i
CID 44520905
Piperazine moiety, 6
CID 57339813
N-{4-[(2-pyridylamino)sulfonyl]phenyl}propanamide
CID 725106
2-methyl-N-[4-(pyridin-2-ylsulfamoyl)phenyl]propanamide
CID 725117
3-(piperidin-1-ylsulfonyl)-N-(pyridin-3-yl)benzamide
CID 812621

Frequently Asked Questions

What is the IUPAC name of 2-pyridin-4-yl-N-(4-sulfamoylphenyl)acetamide?
The IUPAC name of 2-pyridin-4-yl-N-(4-sulfamoylphenyl)acetamide (CID 44520904) is 2-pyridin-4-yl-N-(4-sulfamoylphenyl)acetamide.
What is the SMILES notation for 2-pyridin-4-yl-N-(4-sulfamoylphenyl)acetamide?
The canonical SMILES for 2-pyridin-4-yl-N-(4-sulfamoylphenyl)acetamide is NS(=O)(=O)c1ccc(NC(=O)Cc2ccncc2)cc1.
What is the InChIKey of 2-pyridin-4-yl-N-(4-sulfamoylphenyl)acetamide?
The InChIKey is CXBVXOMVANONBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13N3O3S/c14-20(18,19)12-3-1-11(2-4-12)16-13(17)9-10-5-7-15-8-6-10/h1-8H,9H2,(H,16,17)(H2,14,18,19).
What are the key properties of 2-pyridin-4-yl-N-(4-sulfamoylphenyl)acetamide?
2-pyridin-4-yl-N-(4-sulfamoylphenyl)acetamide has a molecular weight of 291.33 g/mol, XLogP of 0.91, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-pyridin-4-yl-N-(4-sulfamoylphenyl)acetamide is sourced from PubChem (CID 44520904), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).