N-[3-[(4-chlorophenyl)sulfamoyl]phenyl]pyridine-3-carboxamide

C18H14ClN3O3S — CID 51162183

IUPACN-[3-[(4-chlorophenyl)sulfamoyl]phenyl]pyridine-3-carboxamide
SMILESO=C(Nc1cccc(S(=O)(=O)Nc2ccc(Cl)cc2)c1)c1cccnc1
InChIInChI=1S/C18H14ClN3O3S/c19-14-6-8-15(9-7-14)22-26(24,25)17-5-1-4-16(11-17)21-18(23)13-3-2-10-20-12-13/h1-12,22H,(H,21,23)
InChIKeyGQCXGBFQHBIQBW-UHFFFAOYSA-N
MW387.85 g/mol
LogP3.79
Rot. Bonds5

About N-[3-[(4-chlorophenyl)sulfamoyl]phenyl]pyridine-3-carboxamide

N-[3-[(4-chlorophenyl)sulfamoyl]phenyl]pyridine-3-carboxamide (PubChem CID 51162183) has the molecular formula C18H14ClN3O3S and a molecular weight of 387.85 g/mol. Its IUPAC name is N-[3-[(4-chlorophenyl)sulfamoyl]phenyl]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[3-[(4-chlorophenyl)sulfamoyl]phenyl]pyridine-3-carboxamide
PubChem CID51162183
Molecular FormulaC18H14ClN3O3S
Molecular Weight387.85 g/mol
Exact Mass387.04
IUPAC NameN-[3-[(4-chlorophenyl)sulfamoyl]phenyl]pyridine-3-carboxamide
SMILESO=C(Nc1cccc(S(=O)(=O)Nc2ccc(Cl)cc2)c1)c1cccnc1
InChIInChI=1S/C18H14ClN3O3S/c19-14-6-8-15(9-7-14)22-26(24,25)17-5-1-4-16(11-17)21-18(23)13-3-2-10-20-12-13/h1-12,22H,(H,21,23)
InChIKeyGQCXGBFQHBIQBW-UHFFFAOYSA-N
XLogP3.79
TPSA88.16 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.85
LogP ≤ 53.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[3-[(4-chlorophenyl)sulfamoyl]phenyl]pyridine-3-carboxamide?
The IUPAC name of N-[3-[(4-chlorophenyl)sulfamoyl]phenyl]pyridine-3-carboxamide (CID 51162183) is N-[3-[(4-chlorophenyl)sulfamoyl]phenyl]pyridine-3-carboxamide.
What is the SMILES notation for N-[3-[(4-chlorophenyl)sulfamoyl]phenyl]pyridine-3-carboxamide?
The canonical SMILES for N-[3-[(4-chlorophenyl)sulfamoyl]phenyl]pyridine-3-carboxamide is O=C(Nc1cccc(S(=O)(=O)Nc2ccc(Cl)cc2)c1)c1cccnc1.
What is the InChIKey of N-[3-[(4-chlorophenyl)sulfamoyl]phenyl]pyridine-3-carboxamide?
The InChIKey is GQCXGBFQHBIQBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14ClN3O3S/c19-14-6-8-15(9-7-14)22-26(24,25)17-5-1-4-16(11-17)21-18(23)13-3-2-10-20-12-13/h1-12,22H,(H,21,23).
What are the key properties of N-[3-[(4-chlorophenyl)sulfamoyl]phenyl]pyridine-3-carboxamide?
N-[3-[(4-chlorophenyl)sulfamoyl]phenyl]pyridine-3-carboxamide has a molecular weight of 387.85 g/mol, XLogP of 3.79, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[(4-chlorophenyl)sulfamoyl]phenyl]pyridine-3-carboxamide is sourced from PubChem (CID 51162183), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).