2-amino-N-(5-chloro-2-cyanophenyl)pyridine-4-sulfonamide

C12H9ClN4O2S — CID 64920454

IUPAC2-amino-N-(5-chloro-2-cyanophenyl)pyridine-4-sulfonamide
SMILESN#Cc1ccc(Cl)cc1NS(=O)(=O)c1ccnc(N)c1
InChIInChI=1S/C12H9ClN4O2S/c13-9-2-1-8(7-14)11(5-9)17-20(18,19)10-3-4-16-12(15)6-10/h1-6,17H,(H2,15,16)
InChIKeyZRQJOWMLQRTZRI-UHFFFAOYSA-N
MW308.75 g/mol
LogP1.99
Rot. Bonds3

About 2-amino-N-(5-chloro-2-cyanophenyl)pyridine-4-sulfonamide

2-amino-N-(5-chloro-2-cyanophenyl)pyridine-4-sulfonamide (PubChem CID 64920454) has the molecular formula C12H9ClN4O2S and a molecular weight of 308.75 g/mol. Its IUPAC name is 2-amino-N-(5-chloro-2-cyanophenyl)pyridine-4-sulfonamide.

Molecular Properties

Compound Name2-amino-N-(5-chloro-2-cyanophenyl)pyridine-4-sulfonamide
PubChem CID64920454
Molecular FormulaC12H9ClN4O2S
Molecular Weight308.75 g/mol
Exact Mass308.01
IUPAC Name2-amino-N-(5-chloro-2-cyanophenyl)pyridine-4-sulfonamide
SMILESN#Cc1ccc(Cl)cc1NS(=O)(=O)c1ccnc(N)c1
InChIInChI=1S/C12H9ClN4O2S/c13-9-2-1-8(7-14)11(5-9)17-20(18,19)10-3-4-16-12(15)6-10/h1-6,17H,(H2,15,16)
InChIKeyZRQJOWMLQRTZRI-UHFFFAOYSA-N
XLogP1.99
TPSA108.87 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.75
LogP ≤ 51.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

3-bromo-4-chloro-N-(5-chloro-2-cyanophenyl)benzenesulfonamide
CID 106605832
4-amino-N-(5-chloro-2-cyanophenyl)-2-fluorobenzenesulfonamide
CID 64914781
2-amino-N-(5-chloro-2-cyanophenyl)-6-fluorobenzenesulfonamide
CID 64914782
N-[4-[(5-chloro-2-cyanophenyl)sulfamoyl]phenyl]acetamide
CID 154297068
N-(5-chloro-2-cyanophenyl)-2-methylpyrazole-3-sulfonamide
CID 104625509
5-chloro-N-(5-chloro-2-cyanophenyl)-1-methylimidazole-4-sulfonamide
CID 61051415
6-amino-N-(5-bromo-2-cyanophenyl)-5-chloropyridine-3-sulfonamide
CID 107801188
2-[(4-aminopyrimidin-2-yl)amino]-4-chlorobenzonitrile
CID 116796971
N-(5-chloro-2-cyanophenyl)-4-(methylamino)pyridine-3-sulfonamide
CID 64917903
N-(5-bromo-2-cyanophenyl)-3,5-dichlorobenzenesulfonamide
CID 107798417
2-[(6-aminopyrimidin-4-yl)amino]-4-chlorobenzonitrile
CID 80841289
N-(5-chloro-2-cyanophenyl)-11-oxo-1-azatricyclo[6.3.1.04,12]dodeca-4,6,8(12)-triene-6-sulfonamide
CID 7526435

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(5-chloro-2-cyanophenyl)pyridine-4-sulfonamide?
The IUPAC name of 2-amino-N-(5-chloro-2-cyanophenyl)pyridine-4-sulfonamide (CID 64920454) is 2-amino-N-(5-chloro-2-cyanophenyl)pyridine-4-sulfonamide.
What is the SMILES notation for 2-amino-N-(5-chloro-2-cyanophenyl)pyridine-4-sulfonamide?
The canonical SMILES for 2-amino-N-(5-chloro-2-cyanophenyl)pyridine-4-sulfonamide is N#Cc1ccc(Cl)cc1NS(=O)(=O)c1ccnc(N)c1.
What is the InChIKey of 2-amino-N-(5-chloro-2-cyanophenyl)pyridine-4-sulfonamide?
The InChIKey is ZRQJOWMLQRTZRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9ClN4O2S/c13-9-2-1-8(7-14)11(5-9)17-20(18,19)10-3-4-16-12(15)6-10/h1-6,17H,(H2,15,16).
What are the key properties of 2-amino-N-(5-chloro-2-cyanophenyl)pyridine-4-sulfonamide?
2-amino-N-(5-chloro-2-cyanophenyl)pyridine-4-sulfonamide has a molecular weight of 308.75 g/mol, XLogP of 1.99, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(5-chloro-2-cyanophenyl)pyridine-4-sulfonamide is sourced from PubChem (CID 64920454), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).