2-methoxy-N-(3-methyl-2-pyridinyl)-5-(oxolan-3-ylsulfamoyl)benzamide

C18H21N3O5S — CID 146559541

IUPAC2-methoxy-N-(3-methyl-2-pyridinyl)-5-(oxolan-3-ylsulfamoyl)benzamide
SMILESCOc1ccc(S(=O)(=O)NC2CCOC2)cc1C(=O)Nc1ncccc1C
InChIInChI=1S/C18H21N3O5S/c1-12-4-3-8-19-17(12)20-18(22)15-10-14(5-6-16(15)25-2)27(23,24)21-13-7-9-26-11-13/h3-6,8,10,13,21H,7,9,11H2,1-2H3,(H,19,20,22)
InChIKeyWAWCHXYUWGIXPS-UHFFFAOYSA-N
MW391.45 g/mol
LogP1.72
Rot. Bonds6

About 2-methoxy-N-(3-methyl-2-pyridinyl)-5-(oxolan-3-ylsulfamoyl)benzamide

2-methoxy-N-(3-methyl-2-pyridinyl)-5-(oxolan-3-ylsulfamoyl)benzamide (PubChem CID 146559541) has the molecular formula C18H21N3O5S and a molecular weight of 391.45 g/mol. Its IUPAC name is 2-methoxy-N-(3-methyl-2-pyridinyl)-5-(oxolan-3-ylsulfamoyl)benzamide.

Molecular Properties

Compound Name2-methoxy-N-(3-methyl-2-pyridinyl)-5-(oxolan-3-ylsulfamoyl)benzamide
PubChem CID146559541
Molecular FormulaC18H21N3O5S
Molecular Weight391.45 g/mol
Exact Mass391.12
IUPAC Name2-methoxy-N-(3-methyl-2-pyridinyl)-5-(oxolan-3-ylsulfamoyl)benzamide
SMILESCOc1ccc(S(=O)(=O)NC2CCOC2)cc1C(=O)Nc1ncccc1C
InChIInChI=1S/C18H21N3O5S/c1-12-4-3-8-19-17(12)20-18(22)15-10-14(5-6-16(15)25-2)27(23,24)21-13-7-9-26-11-13/h3-6,8,10,13,21H,7,9,11H2,1-2H3,(H,19,20,22)
InChIKeyWAWCHXYUWGIXPS-UHFFFAOYSA-N
XLogP1.72
TPSA106.62 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500391.45
LogP ≤ 51.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-(3-chloro-2-pyridinyl)-2-methoxy-5-(oxolan-3-ylsulfamoyl)benzamide
CID 146559576
2-methoxy-N-(5-methyl-1,3-thiazol-2-yl)-5-[[(3S)-oxolan-3-yl]sulfamoyl]benzamide
CID 146255998
N-(3,5-difluorophenyl)-2-methoxy-5-[[(3S)-oxolan-3-yl]sulfamoyl]benzamide
CID 146237287
N-(2-fluorophenyl)-2-methoxy-5-[[(3S)-oxolan-3-yl]sulfamoyl]benzamide
CID 146256155
N-(3,5-dichlorophenyl)-2-methoxy-5-(oxolan-3-ylsulfamoyl)benzamide
CID 146559583
N-(4-bromophenyl)-2-methoxy-5-[[(3S)-oxolan-3-yl]sulfamoyl]benzamide
CID 146256157
N-(4-bromophenyl)-2-methoxy-5-(oxolan-3-ylsulfamoyl)benzamide
CID 146559539
N-(5-fluoro-4-methylpyrimidin-2-yl)-2-methoxy-5-(oxolan-3-ylsulfamoyl)benzamide
CID 146237320
N-(3-chlorophenyl)-2-methoxy-5-[[(3S)-oxolan-3-yl]sulfamoyl]benzamide
CID 146256158
2-methoxy-5-(oxolan-3-ylsulfamoyl)-N-(2,4,5-trifluorophenyl)benzamide
CID 146559528
N-(2,4-difluorophenyl)-2-methoxy-5-[[(3S)-oxolan-3-yl]sulfamoyl]benzamide
CID 146255929
N-(2,5-dichlorophenyl)-2-methoxy-5-(oxolan-3-ylsulfamoyl)benzamide
CID 146237316

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-(3-methyl-2-pyridinyl)-5-(oxolan-3-ylsulfamoyl)benzamide?
The IUPAC name of 2-methoxy-N-(3-methyl-2-pyridinyl)-5-(oxolan-3-ylsulfamoyl)benzamide (CID 146559541) is 2-methoxy-N-(3-methyl-2-pyridinyl)-5-(oxolan-3-ylsulfamoyl)benzamide.
What is the SMILES notation for 2-methoxy-N-(3-methyl-2-pyridinyl)-5-(oxolan-3-ylsulfamoyl)benzamide?
The canonical SMILES for 2-methoxy-N-(3-methyl-2-pyridinyl)-5-(oxolan-3-ylsulfamoyl)benzamide is COc1ccc(S(=O)(=O)NC2CCOC2)cc1C(=O)Nc1ncccc1C.
What is the InChIKey of 2-methoxy-N-(3-methyl-2-pyridinyl)-5-(oxolan-3-ylsulfamoyl)benzamide?
The InChIKey is WAWCHXYUWGIXPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N3O5S/c1-12-4-3-8-19-17(12)20-18(22)15-10-14(5-6-16(15)25-2)27(23,24)21-13-7-9-26-11-13/h3-6,8,10,13,21H,7,9,11H2,1-2H3,(H,19,20,22).
What are the key properties of 2-methoxy-N-(3-methyl-2-pyridinyl)-5-(oxolan-3-ylsulfamoyl)benzamide?
2-methoxy-N-(3-methyl-2-pyridinyl)-5-(oxolan-3-ylsulfamoyl)benzamide has a molecular weight of 391.45 g/mol, XLogP of 1.72, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-(3-methyl-2-pyridinyl)-5-(oxolan-3-ylsulfamoyl)benzamide is sourced from PubChem (CID 146559541), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).