3-(diethylsulfamoyl)-4-methoxy-N-(5-methyl-2-pyridinyl)benzamide

C18H23N3O4S — CID 18106773

IUPAC3-(diethylsulfamoyl)-4-methoxy-N-(5-methyl-2-pyridinyl)benzamide
SMILESCCN(CC)S(=O)(=O)c1cc(C(=O)Nc2ccc(C)cn2)ccc1OC
InChIInChI=1S/C18H23N3O4S/c1-5-21(6-2)26(23,24)16-11-14(8-9-15(16)25-4)18(22)20-17-10-7-13(3)12-19-17/h7-12H,5-6H2,1-4H3,(H,19,20,22)
InChIKeyYIBLQZZBMPABPI-UHFFFAOYSA-N
MW377.47 g/mol
LogP2.68
Rot. Bonds7

About 3-(diethylsulfamoyl)-4-methoxy-N-(5-methyl-2-pyridinyl)benzamide

3-(diethylsulfamoyl)-4-methoxy-N-(5-methyl-2-pyridinyl)benzamide (PubChem CID 18106773) has the molecular formula C18H23N3O4S and a molecular weight of 377.47 g/mol. Its IUPAC name is 3-(diethylsulfamoyl)-4-methoxy-N-(5-methyl-2-pyridinyl)benzamide.

Molecular Properties

Compound Name3-(diethylsulfamoyl)-4-methoxy-N-(5-methyl-2-pyridinyl)benzamide
PubChem CID18106773
Molecular FormulaC18H23N3O4S
Molecular Weight377.47 g/mol
Exact Mass377.14
IUPAC Name3-(diethylsulfamoyl)-4-methoxy-N-(5-methyl-2-pyridinyl)benzamide
SMILESCCN(CC)S(=O)(=O)c1cc(C(=O)Nc2ccc(C)cn2)ccc1OC
InChIInChI=1S/C18H23N3O4S/c1-5-21(6-2)26(23,24)16-11-14(8-9-15(16)25-4)18(22)20-17-10-7-13(3)12-19-17/h7-12H,5-6H2,1-4H3,(H,19,20,22)
InChIKeyYIBLQZZBMPABPI-UHFFFAOYSA-N
XLogP2.68
TPSA88.60 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.47
LogP ≤ 52.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-(diethylsulfamoyl)-4-methoxy-N-(5-methyl-2-pyridinyl)benzamide?
The IUPAC name of 3-(diethylsulfamoyl)-4-methoxy-N-(5-methyl-2-pyridinyl)benzamide (CID 18106773) is 3-(diethylsulfamoyl)-4-methoxy-N-(5-methyl-2-pyridinyl)benzamide.
What is the SMILES notation for 3-(diethylsulfamoyl)-4-methoxy-N-(5-methyl-2-pyridinyl)benzamide?
The canonical SMILES for 3-(diethylsulfamoyl)-4-methoxy-N-(5-methyl-2-pyridinyl)benzamide is CCN(CC)S(=O)(=O)c1cc(C(=O)Nc2ccc(C)cn2)ccc1OC.
What is the InChIKey of 3-(diethylsulfamoyl)-4-methoxy-N-(5-methyl-2-pyridinyl)benzamide?
The InChIKey is YIBLQZZBMPABPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N3O4S/c1-5-21(6-2)26(23,24)16-11-14(8-9-15(16)25-4)18(22)20-17-10-7-13(3)12-19-17/h7-12H,5-6H2,1-4H3,(H,19,20,22).
What are the key properties of 3-(diethylsulfamoyl)-4-methoxy-N-(5-methyl-2-pyridinyl)benzamide?
3-(diethylsulfamoyl)-4-methoxy-N-(5-methyl-2-pyridinyl)benzamide has a molecular weight of 377.47 g/mol, XLogP of 2.68, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(diethylsulfamoyl)-4-methoxy-N-(5-methyl-2-pyridinyl)benzamide is sourced from PubChem (CID 18106773), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).