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

C14H15N3O3S — CID 62340011

IUPAC3-methyl-N-[4-(sulfamoylmethyl)phenyl]pyridine-2-carboxamide
SMILESCc1cccnc1C(=O)Nc1ccc(CS(N)(=O)=O)cc1
InChIInChI=1S/C14H15N3O3S/c1-10-3-2-8-16-13(10)14(18)17-12-6-4-11(5-7-12)9-21(15,19)20/h2-8H,9H2,1H3,(H,17,18)(H2,15,19,20)
InChIKeyXISVGPZBPGXPIO-UHFFFAOYSA-N
MW305.36 g/mol
LogP1.43
Rot. Bonds4

About 3-methyl-N-[4-(sulfamoylmethyl)phenyl]pyridine-2-carboxamide

3-methyl-N-[4-(sulfamoylmethyl)phenyl]pyridine-2-carboxamide (PubChem CID 62340011) has the molecular formula C14H15N3O3S and a molecular weight of 305.36 g/mol. Its IUPAC name is 3-methyl-N-[4-(sulfamoylmethyl)phenyl]pyridine-2-carboxamide.

Molecular Properties

Compound Name3-methyl-N-[4-(sulfamoylmethyl)phenyl]pyridine-2-carboxamide
PubChem CID62340011
Molecular FormulaC14H15N3O3S
Molecular Weight305.36 g/mol
Exact Mass305.08
IUPAC Name3-methyl-N-[4-(sulfamoylmethyl)phenyl]pyridine-2-carboxamide
SMILESCc1cccnc1C(=O)Nc1ccc(CS(N)(=O)=O)cc1
InChIInChI=1S/C14H15N3O3S/c1-10-3-2-8-16-13(10)14(18)17-12-6-4-11(5-7-12)9-21(15,19)20/h2-8H,9H2,1H3,(H,17,18)(H2,15,19,20)
InChIKeyXISVGPZBPGXPIO-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 3-methyl-N-[4-(sulfamoylmethyl)phenyl]pyridine-2-carboxamide?
The IUPAC name of 3-methyl-N-[4-(sulfamoylmethyl)phenyl]pyridine-2-carboxamide (CID 62340011) is 3-methyl-N-[4-(sulfamoylmethyl)phenyl]pyridine-2-carboxamide.
What is the SMILES notation for 3-methyl-N-[4-(sulfamoylmethyl)phenyl]pyridine-2-carboxamide?
The canonical SMILES for 3-methyl-N-[4-(sulfamoylmethyl)phenyl]pyridine-2-carboxamide is Cc1cccnc1C(=O)Nc1ccc(CS(N)(=O)=O)cc1.
What is the InChIKey of 3-methyl-N-[4-(sulfamoylmethyl)phenyl]pyridine-2-carboxamide?
The InChIKey is XISVGPZBPGXPIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O3S/c1-10-3-2-8-16-13(10)14(18)17-12-6-4-11(5-7-12)9-21(15,19)20/h2-8H,9H2,1H3,(H,17,18)(H2,15,19,20).
What are the key properties of 3-methyl-N-[4-(sulfamoylmethyl)phenyl]pyridine-2-carboxamide?
3-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 3-methyl-N-[4-(sulfamoylmethyl)phenyl]pyridine-2-carboxamide is sourced from PubChem (CID 62340011), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).