N-[2-chloro-5-(diethylsulfamoyl)phenyl]pyridine-4-carboxamide

C16H18ClN3O3S — CID 2963512

IUPACN-[2-chloro-5-(diethylsulfamoyl)phenyl]pyridine-4-carboxamide
SMILESCCN(CC)S(=O)(=O)c1ccc(Cl)c(NC(=O)c2ccncc2)c1
InChIInChI=1S/C16H18ClN3O3S/c1-3-20(4-2)24(22,23)13-5-6-14(17)15(11-13)19-16(21)12-7-9-18-10-8-12/h5-11H,3-4H2,1-2H3,(H,19,21)
InChIKeyDTGBWSFIOZZYCK-UHFFFAOYSA-N
MW367.86 g/mol
LogP3.02
Rot. Bonds6

About N-[2-chloro-5-(diethylsulfamoyl)phenyl]pyridine-4-carboxamide

N-[2-chloro-5-(diethylsulfamoyl)phenyl]pyridine-4-carboxamide (PubChem CID 2963512) has the molecular formula C16H18ClN3O3S and a molecular weight of 367.86 g/mol. Its IUPAC name is N-[2-chloro-5-(diethylsulfamoyl)phenyl]pyridine-4-carboxamide.

Molecular Properties

Compound NameN-[2-chloro-5-(diethylsulfamoyl)phenyl]pyridine-4-carboxamide
PubChem CID2963512
Molecular FormulaC16H18ClN3O3S
Molecular Weight367.86 g/mol
Exact Mass367.08
IUPAC NameN-[2-chloro-5-(diethylsulfamoyl)phenyl]pyridine-4-carboxamide
SMILESCCN(CC)S(=O)(=O)c1ccc(Cl)c(NC(=O)c2ccncc2)c1
InChIInChI=1S/C16H18ClN3O3S/c1-3-20(4-2)24(22,23)13-5-6-14(17)15(11-13)19-16(21)12-7-9-18-10-8-12/h5-11H,3-4H2,1-2H3,(H,19,21)
InChIKeyDTGBWSFIOZZYCK-UHFFFAOYSA-N
XLogP3.02
TPSA79.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.86
LogP ≤ 53.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-chloro-5-(diethylsulfamoyl)phenyl]-4-propan-2-ylsulfonylbenzamide
CID 55752915
N-(2-chloro-5-pyrrolidin-1-ylsulfonylphenyl)pyridine-4-carboxamide
CID 4651643
5-chloro-N-[2-chloro-5-(diethylsulfamoyl)phenyl]-2-methoxybenzamide
CID 55343210
N-[2-chloro-5-(diethylsulfamoyl)phenyl]-2-(2-cyanophenyl)benzamide
CID 55381133
ethyl 4-chloro-3-(pyridine-4-carbonylamino)benzoate
CID 7311998
N-[5-(diethylsulfamoyl)-2-hydroxyphenyl]-4-propan-2-ylbenzamide
CID 35993040
4-chloro-3-(pyridine-4-carbonylamino)benzoic acid
CID 24688561
N-[2-chloro-5-(diethylsulfamoyl)phenyl]-2-methyl-4-phenyl-1,3-thiazole-5-carboxamide
CID 112797360
N-(2,4,5-trichlorophenyl)pyridine-4-carboxamide
CID 4098506
N-[2-chloro-5-(dimethylsulfamoyl)phenyl]-4-cyanobenzamide
CID 5218436
2-chloro-4-[[4-(diethylsulfamoyl)benzoyl]amino]benzamide
CID 39171138
1-[2-chloro-5-(diethylsulfamoyl)phenyl]-3-(3-pyrazol-1-ylpropyl)urea
CID 55696278

Frequently Asked Questions

What is the IUPAC name of N-[2-chloro-5-(diethylsulfamoyl)phenyl]pyridine-4-carboxamide?
The IUPAC name of N-[2-chloro-5-(diethylsulfamoyl)phenyl]pyridine-4-carboxamide (CID 2963512) is N-[2-chloro-5-(diethylsulfamoyl)phenyl]pyridine-4-carboxamide.
What is the SMILES notation for N-[2-chloro-5-(diethylsulfamoyl)phenyl]pyridine-4-carboxamide?
The canonical SMILES for N-[2-chloro-5-(diethylsulfamoyl)phenyl]pyridine-4-carboxamide is CCN(CC)S(=O)(=O)c1ccc(Cl)c(NC(=O)c2ccncc2)c1.
What is the InChIKey of N-[2-chloro-5-(diethylsulfamoyl)phenyl]pyridine-4-carboxamide?
The InChIKey is DTGBWSFIOZZYCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18ClN3O3S/c1-3-20(4-2)24(22,23)13-5-6-14(17)15(11-13)19-16(21)12-7-9-18-10-8-12/h5-11H,3-4H2,1-2H3,(H,19,21).
What are the key properties of N-[2-chloro-5-(diethylsulfamoyl)phenyl]pyridine-4-carboxamide?
N-[2-chloro-5-(diethylsulfamoyl)phenyl]pyridine-4-carboxamide has a molecular weight of 367.86 g/mol, XLogP of 3.02, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-chloro-5-(diethylsulfamoyl)phenyl]pyridine-4-carboxamide is sourced from PubChem (CID 2963512), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).