6-methyl-N-[4-(sulfamoylmethyl)phenyl]pyridine-2-carboxamide

C14H15N3O3S — CID 60727200

IUPAC6-methyl-N-[4-(sulfamoylmethyl)phenyl]pyridine-2-carboxamide
SMILESCc1cccc(C(=O)Nc2ccc(CS(N)(=O)=O)cc2)n1
InChIInChI=1S/C14H15N3O3S/c1-10-3-2-4-13(16-10)14(18)17-12-7-5-11(6-8-12)9-21(15,19)20/h2-8H,9H2,1H3,(H,17,18)(H2,15,19,20)
InChIKeyOQFBYAXTLJDXAF-UHFFFAOYSA-N
MW305.36 g/mol
LogP1.43
Rot. Bonds4

About 6-methyl-N-[4-(sulfamoylmethyl)phenyl]pyridine-2-carboxamide

6-methyl-N-[4-(sulfamoylmethyl)phenyl]pyridine-2-carboxamide (PubChem CID 60727200) has the molecular formula C14H15N3O3S and a molecular weight of 305.36 g/mol. Its IUPAC name is 6-methyl-N-[4-(sulfamoylmethyl)phenyl]pyridine-2-carboxamide.

Molecular Properties

Compound Name6-methyl-N-[4-(sulfamoylmethyl)phenyl]pyridine-2-carboxamide
PubChem CID60727200
Molecular FormulaC14H15N3O3S
Molecular Weight305.36 g/mol
Exact Mass305.08
IUPAC Name6-methyl-N-[4-(sulfamoylmethyl)phenyl]pyridine-2-carboxamide
SMILESCc1cccc(C(=O)Nc2ccc(CS(N)(=O)=O)cc2)n1
InChIInChI=1S/C14H15N3O3S/c1-10-3-2-4-13(16-10)14(18)17-12-7-5-11(6-8-12)9-21(15,19)20/h2-8H,9H2,1H3,(H,17,18)(H2,15,19,20)
InChIKeyOQFBYAXTLJDXAF-UHFFFAOYSA-N
XLogP1.43
TPSA102.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.36
LogP ≤ 51.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-methyl-N-[4-(sulfamoylmethyl)phenyl]pyridine-2-carboxamide?
The IUPAC name of 6-methyl-N-[4-(sulfamoylmethyl)phenyl]pyridine-2-carboxamide (CID 60727200) is 6-methyl-N-[4-(sulfamoylmethyl)phenyl]pyridine-2-carboxamide.
What is the SMILES notation for 6-methyl-N-[4-(sulfamoylmethyl)phenyl]pyridine-2-carboxamide?
The canonical SMILES for 6-methyl-N-[4-(sulfamoylmethyl)phenyl]pyridine-2-carboxamide is Cc1cccc(C(=O)Nc2ccc(CS(N)(=O)=O)cc2)n1.
What is the InChIKey of 6-methyl-N-[4-(sulfamoylmethyl)phenyl]pyridine-2-carboxamide?
The InChIKey is OQFBYAXTLJDXAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O3S/c1-10-3-2-4-13(16-10)14(18)17-12-7-5-11(6-8-12)9-21(15,19)20/h2-8H,9H2,1H3,(H,17,18)(H2,15,19,20).
What are the key properties of 6-methyl-N-[4-(sulfamoylmethyl)phenyl]pyridine-2-carboxamide?
6-methyl-N-[4-(sulfamoylmethyl)phenyl]pyridine-2-carboxamide has a molecular weight of 305.36 g/mol, XLogP of 1.43, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-N-[4-(sulfamoylmethyl)phenyl]pyridine-2-carboxamide is sourced from PubChem (CID 60727200), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).