N-[5-(dimethylsulfamoyl)-2-pyridinyl]-2-methoxybenzamide

C15H17N3O4S — CID 71689972

IUPACN-[5-(dimethylsulfamoyl)-2-pyridinyl]-2-methoxybenzamide
SMILESCOc1ccccc1C(=O)Nc1ccc(S(=O)(=O)N(C)C)cn1
InChIInChI=1S/C15H17N3O4S/c1-18(2)23(20,21)11-8-9-14(16-10-11)17-15(19)12-6-4-5-7-13(12)22-3/h4-10H,1-3H3,(H,16,17,19)
InChIKeyZPPSTURTJROJBS-UHFFFAOYSA-N
MW335.39 g/mol
LogP1.59
Rot. Bonds5

About N-[5-(dimethylsulfamoyl)-2-pyridinyl]-2-methoxybenzamide

N-[5-(dimethylsulfamoyl)-2-pyridinyl]-2-methoxybenzamide (PubChem CID 71689972) has the molecular formula C15H17N3O4S and a molecular weight of 335.39 g/mol. Its IUPAC name is N-[5-(dimethylsulfamoyl)-2-pyridinyl]-2-methoxybenzamide.

Molecular Properties

Compound NameN-[5-(dimethylsulfamoyl)-2-pyridinyl]-2-methoxybenzamide
PubChem CID71689972
Molecular FormulaC15H17N3O4S
Molecular Weight335.39 g/mol
Exact Mass335.09
IUPAC NameN-[5-(dimethylsulfamoyl)-2-pyridinyl]-2-methoxybenzamide
SMILESCOc1ccccc1C(=O)Nc1ccc(S(=O)(=O)N(C)C)cn1
InChIInChI=1S/C15H17N3O4S/c1-18(2)23(20,21)11-8-9-14(16-10-11)17-15(19)12-6-4-5-7-13(12)22-3/h4-10H,1-3H3,(H,16,17,19)
InChIKeyZPPSTURTJROJBS-UHFFFAOYSA-N
XLogP1.59
TPSA88.60 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.39
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[5-(dimethylsulfamoyl)-2-pyridinyl]-2-methoxybenzamide?
The IUPAC name of N-[5-(dimethylsulfamoyl)-2-pyridinyl]-2-methoxybenzamide (CID 71689972) is N-[5-(dimethylsulfamoyl)-2-pyridinyl]-2-methoxybenzamide.
What is the SMILES notation for N-[5-(dimethylsulfamoyl)-2-pyridinyl]-2-methoxybenzamide?
The canonical SMILES for N-[5-(dimethylsulfamoyl)-2-pyridinyl]-2-methoxybenzamide is COc1ccccc1C(=O)Nc1ccc(S(=O)(=O)N(C)C)cn1.
What is the InChIKey of N-[5-(dimethylsulfamoyl)-2-pyridinyl]-2-methoxybenzamide?
The InChIKey is ZPPSTURTJROJBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O4S/c1-18(2)23(20,21)11-8-9-14(16-10-11)17-15(19)12-6-4-5-7-13(12)22-3/h4-10H,1-3H3,(H,16,17,19).
What are the key properties of N-[5-(dimethylsulfamoyl)-2-pyridinyl]-2-methoxybenzamide?
N-[5-(dimethylsulfamoyl)-2-pyridinyl]-2-methoxybenzamide has a molecular weight of 335.39 g/mol, XLogP of 1.59, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(dimethylsulfamoyl)-2-pyridinyl]-2-methoxybenzamide is sourced from PubChem (CID 71689972), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).