3-(diethylsulfamoyl)-N-[(2-methoxy-3-pyridinyl)methyl]benzamide

C18H23N3O4S — CID 38533714

IUPAC3-(diethylsulfamoyl)-N-[(2-methoxy-3-pyridinyl)methyl]benzamide
SMILESCCN(CC)S(=O)(=O)c1cccc(C(=O)NCc2cccnc2OC)c1
InChIInChI=1S/C18H23N3O4S/c1-4-21(5-2)26(23,24)16-10-6-8-14(12-16)17(22)20-13-15-9-7-11-19-18(15)25-3/h6-12H,4-5,13H2,1-3H3,(H,20,22)
InChIKeyNPIPOESLVRIWIQ-UHFFFAOYSA-N
MW377.47 g/mol
LogP2.05
Rot. Bonds8

About 3-(diethylsulfamoyl)-N-[(2-methoxy-3-pyridinyl)methyl]benzamide

3-(diethylsulfamoyl)-N-[(2-methoxy-3-pyridinyl)methyl]benzamide (PubChem CID 38533714) has the molecular formula C18H23N3O4S and a molecular weight of 377.47 g/mol. Its IUPAC name is 3-(diethylsulfamoyl)-N-[(2-methoxy-3-pyridinyl)methyl]benzamide.

Molecular Properties

Compound Name3-(diethylsulfamoyl)-N-[(2-methoxy-3-pyridinyl)methyl]benzamide
PubChem CID38533714
Molecular FormulaC18H23N3O4S
Molecular Weight377.47 g/mol
Exact Mass377.14
IUPAC Name3-(diethylsulfamoyl)-N-[(2-methoxy-3-pyridinyl)methyl]benzamide
SMILESCCN(CC)S(=O)(=O)c1cccc(C(=O)NCc2cccnc2OC)c1
InChIInChI=1S/C18H23N3O4S/c1-4-21(5-2)26(23,24)16-10-6-8-14(12-16)17(22)20-13-15-9-7-11-19-18(15)25-3/h6-12H,4-5,13H2,1-3H3,(H,20,22)
InChIKeyNPIPOESLVRIWIQ-UHFFFAOYSA-N
XLogP2.05
TPSA88.60 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.47
LogP ≤ 52.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-[ethyl(phenyl)sulfamoyl]-N-[(2-methoxy-3-pyridinyl)methyl]benzamide
CID 37486403
3-(azepan-1-ylsulfonyl)-N-[(2-methoxy-3-pyridinyl)methyl]benzamide
CID 38533968
3-[(2-fluorophenyl)sulfamoyl]-N-[(2-methoxy-3-pyridinyl)methyl]benzamide
CID 39248461
3,5-dibromo-N-[(2-methoxy-3-pyridinyl)methyl]benzamide
CID 103907640
3-(diethylsulfamoyl)-N-propylbenzamide
CID 2709423
3-(diethylsulfamoyl)-N-[[3-(2-methylpropanoylamino)phenyl]methyl]benzamide
CID 33022275
N-[(2-cyclopentyloxyphenyl)methyl]-3-(diethylsulfamoyl)benzamide
CID 52656968
3-[ethyl(phenyl)sulfamoyl]-N-[(2-methoxyphenyl)methyl]benzamide
CID 26734441
3-(diethylsulfamoyl)-N-methylbenzamide
CID 47099917
3-(tert-butylsulfamoyl)-4-methoxy-N-[(2-methoxy-3-pyridinyl)methyl]benzamide
CID 37485901
3-(diethylsulfamoyl)-N-[2-(dimethylamino)ethyl]benzamide
CID 2196169
N-[(2-methoxyphenyl)methyl]-3-[methyl(propan-2-yl)sulfamoyl]benzamide
CID 26734370

Frequently Asked Questions

What is the IUPAC name of 3-(diethylsulfamoyl)-N-[(2-methoxy-3-pyridinyl)methyl]benzamide?
The IUPAC name of 3-(diethylsulfamoyl)-N-[(2-methoxy-3-pyridinyl)methyl]benzamide (CID 38533714) is 3-(diethylsulfamoyl)-N-[(2-methoxy-3-pyridinyl)methyl]benzamide.
What is the SMILES notation for 3-(diethylsulfamoyl)-N-[(2-methoxy-3-pyridinyl)methyl]benzamide?
The canonical SMILES for 3-(diethylsulfamoyl)-N-[(2-methoxy-3-pyridinyl)methyl]benzamide is CCN(CC)S(=O)(=O)c1cccc(C(=O)NCc2cccnc2OC)c1.
What is the InChIKey of 3-(diethylsulfamoyl)-N-[(2-methoxy-3-pyridinyl)methyl]benzamide?
The InChIKey is NPIPOESLVRIWIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N3O4S/c1-4-21(5-2)26(23,24)16-10-6-8-14(12-16)17(22)20-13-15-9-7-11-19-18(15)25-3/h6-12H,4-5,13H2,1-3H3,(H,20,22).
What are the key properties of 3-(diethylsulfamoyl)-N-[(2-methoxy-3-pyridinyl)methyl]benzamide?
3-(diethylsulfamoyl)-N-[(2-methoxy-3-pyridinyl)methyl]benzamide has a molecular weight of 377.47 g/mol, XLogP of 2.05, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(diethylsulfamoyl)-N-[(2-methoxy-3-pyridinyl)methyl]benzamide is sourced from PubChem (CID 38533714), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).