N-[3-(dimethylsulfamoyl)-4-methylphenyl]pyridine-3-carboxamide

C15H17N3O3S — CID 4879012

IUPACN-[3-(dimethylsulfamoyl)-4-methylphenyl]pyridine-3-carboxamide
SMILESCc1ccc(NC(=O)c2cccnc2)cc1S(=O)(=O)N(C)C
InChIInChI=1S/C15H17N3O3S/c1-11-6-7-13(9-14(11)22(20,21)18(2)3)17-15(19)12-5-4-8-16-10-12/h4-10H,1-3H3,(H,17,19)
InChIKeyYORLUEKALAHEMX-UHFFFAOYSA-N
MW319.39 g/mol
LogP1.89
Rot. Bonds4

About N-[3-(dimethylsulfamoyl)-4-methylphenyl]pyridine-3-carboxamide

N-[3-(dimethylsulfamoyl)-4-methylphenyl]pyridine-3-carboxamide (PubChem CID 4879012) has the molecular formula C15H17N3O3S and a molecular weight of 319.39 g/mol. Its IUPAC name is N-[3-(dimethylsulfamoyl)-4-methylphenyl]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[3-(dimethylsulfamoyl)-4-methylphenyl]pyridine-3-carboxamide
PubChem CID4879012
Molecular FormulaC15H17N3O3S
Molecular Weight319.39 g/mol
Exact Mass319.10
IUPAC NameN-[3-(dimethylsulfamoyl)-4-methylphenyl]pyridine-3-carboxamide
SMILESCc1ccc(NC(=O)c2cccnc2)cc1S(=O)(=O)N(C)C
InChIInChI=1S/C15H17N3O3S/c1-11-6-7-13(9-14(11)22(20,21)18(2)3)17-15(19)12-5-4-8-16-10-12/h4-10H,1-3H3,(H,17,19)
InChIKeyYORLUEKALAHEMX-UHFFFAOYSA-N
XLogP1.89
TPSA79.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.39
LogP ≤ 51.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

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CID 711634
N-(4-propan-2-ylphenyl)pyridine-3-carboxamide
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N-(3-methylphenyl)pyridine-3-carboxamide
CID 532819
Sulfonamide deriv., 7h
CID 44520904
3-(piperidin-1-ylsulfonyl)-N-(pyridin-3-yl)benzamide
CID 812621
4-(Benzenesulfonyl-methyl-amino)-N-pyridin-3-yl-benzamide
CID 1118209
6-chloro-N-(4-piperidin-1-ylsulfonylphenyl)pyridine-3-carboxamide
CID 2121872
N-[3-(1-pyrrolidinylsulfonyl)phenyl]isonicotinamide
CID 2963518
2-(methylsulfanyl)-N-[3-(pyrrolidine-1-sulfonyl)phenyl]pyridine-3-carboxamide
CID 3672825
2-(Methylthio)-N-(3-(morpholinosulfonyl)phenyl)nicotinamide
CID 4308744
4-[(3-nitrophenyl)sulfonylamino]-N-(pyridin-3-ylmethyl)benzamide
CID 4560041
N-[3-(azepan-1-ylsulfonyl)phenyl]-5-bromopyridine-3-carboxamide
CID 4587660

Frequently Asked Questions

What is the IUPAC name of N-[3-(dimethylsulfamoyl)-4-methylphenyl]pyridine-3-carboxamide?
The IUPAC name of N-[3-(dimethylsulfamoyl)-4-methylphenyl]pyridine-3-carboxamide (CID 4879012) is N-[3-(dimethylsulfamoyl)-4-methylphenyl]pyridine-3-carboxamide.
What is the SMILES notation for N-[3-(dimethylsulfamoyl)-4-methylphenyl]pyridine-3-carboxamide?
The canonical SMILES for N-[3-(dimethylsulfamoyl)-4-methylphenyl]pyridine-3-carboxamide is Cc1ccc(NC(=O)c2cccnc2)cc1S(=O)(=O)N(C)C.
What is the InChIKey of N-[3-(dimethylsulfamoyl)-4-methylphenyl]pyridine-3-carboxamide?
The InChIKey is YORLUEKALAHEMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O3S/c1-11-6-7-13(9-14(11)22(20,21)18(2)3)17-15(19)12-5-4-8-16-10-12/h4-10H,1-3H3,(H,17,19).
What are the key properties of N-[3-(dimethylsulfamoyl)-4-methylphenyl]pyridine-3-carboxamide?
N-[3-(dimethylsulfamoyl)-4-methylphenyl]pyridine-3-carboxamide has a molecular weight of 319.39 g/mol, XLogP of 1.89, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(dimethylsulfamoyl)-4-methylphenyl]pyridine-3-carboxamide is sourced from PubChem (CID 4879012), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).