N-(2-hydroxyethyl)-2-[(5-methoxy-3-pyridinyl)sulfamoyl]-N-propan-2-ylbenzamide

C18H23N3O5S — CID 58924202

IUPACN-(2-hydroxyethyl)-2-[(5-methoxy-3-pyridinyl)sulfamoyl]-N-propan-2-ylbenzamide
SMILESCOc1cncc(NS(=O)(=O)c2ccccc2C(=O)N(CCO)C(C)C)c1
InChIInChI=1S/C18H23N3O5S/c1-13(2)21(8-9-22)18(23)16-6-4-5-7-17(16)27(24,25)20-14-10-15(26-3)12-19-11-14/h4-7,10-13,20,22H,8-9H2,1-3H3
InChIKeyKBSQQVPONNYLST-UHFFFAOYSA-N
MW393.47 g/mol
LogP1.73
Rot. Bonds8

About N-(2-hydroxyethyl)-2-[(5-methoxy-3-pyridinyl)sulfamoyl]-N-propan-2-ylbenzamide

N-(2-hydroxyethyl)-2-[(5-methoxy-3-pyridinyl)sulfamoyl]-N-propan-2-ylbenzamide (PubChem CID 58924202) has the molecular formula C18H23N3O5S and a molecular weight of 393.47 g/mol. Its IUPAC name is N-(2-hydroxyethyl)-2-[(5-methoxy-3-pyridinyl)sulfamoyl]-N-propan-2-ylbenzamide.

Molecular Properties

Compound NameN-(2-hydroxyethyl)-2-[(5-methoxy-3-pyridinyl)sulfamoyl]-N-propan-2-ylbenzamide
PubChem CID58924202
Molecular FormulaC18H23N3O5S
Molecular Weight393.47 g/mol
Exact Mass393.14
IUPAC NameN-(2-hydroxyethyl)-2-[(5-methoxy-3-pyridinyl)sulfamoyl]-N-propan-2-ylbenzamide
SMILESCOc1cncc(NS(=O)(=O)c2ccccc2C(=O)N(CCO)C(C)C)c1
InChIInChI=1S/C18H23N3O5S/c1-13(2)21(8-9-22)18(23)16-6-4-5-7-17(16)27(24,25)20-14-10-15(26-3)12-19-11-14/h4-7,10-13,20,22H,8-9H2,1-3H3
InChIKeyKBSQQVPONNYLST-UHFFFAOYSA-N
XLogP1.73
TPSA108.83 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500393.47
LogP ≤ 51.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-ethyl-2-[(5-methoxy-3-pyridinyl)sulfamoyl]-N-propylbenzamide
CID 58924348
2-[(5-methoxy-3-pyridinyl)sulfamoyl]-N-methyl-N-(2-phenoxyethyl)benzamide
CID 58924319
2-[(5-methoxy-3-pyridinyl)sulfamoyl]-N-(2-methylbutyl)benzamide
CID 58924307
N-[(3-chlorophenyl)methyl]-2-[(5-methoxy-3-pyridinyl)sulfamoyl]benzamide
CID 58924260
N-[(3,4-difluorophenyl)methyl]-2-[(5-methoxy-3-pyridinyl)sulfamoyl]benzamide
CID 58924121
2-[(5-methoxy-3-pyridinyl)sulfamoyl]-N-[(4-methylsulfonylphenyl)methyl]benzamide
CID 58924134
N-[2-(2,5-difluorophenyl)ethyl]-2-[(5-methoxy-3-pyridinyl)sulfamoyl]benzamide
CID 58924145
N-[2-(2-chlorophenyl)ethyl]-2-[(5-methoxy-3-pyridinyl)sulfamoyl]benzamide
CID 58924321
N-[(2,3-difluorophenyl)methyl]-2-[(5-methoxy-3-pyridinyl)sulfamoyl]benzamide
CID 58924343
N-(5-methoxy-3-pyridinyl)-2-(trifluoromethyl)benzenesulfonamide
CID 134137036
N-(2-methoxyethyl)-2-[(4-methoxy-3-pyridinyl)sulfamoyl]-N-propan-2-ylbenzamide
CID 58924014
2-(3,3-dimethylpiperidine-1-carbonyl)-N-(5-methoxy-3-pyridinyl)benzenesulfonamide
CID 58924081

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxyethyl)-2-[(5-methoxy-3-pyridinyl)sulfamoyl]-N-propan-2-ylbenzamide?
The IUPAC name of N-(2-hydroxyethyl)-2-[(5-methoxy-3-pyridinyl)sulfamoyl]-N-propan-2-ylbenzamide (CID 58924202) is N-(2-hydroxyethyl)-2-[(5-methoxy-3-pyridinyl)sulfamoyl]-N-propan-2-ylbenzamide.
What is the SMILES notation for N-(2-hydroxyethyl)-2-[(5-methoxy-3-pyridinyl)sulfamoyl]-N-propan-2-ylbenzamide?
The canonical SMILES for N-(2-hydroxyethyl)-2-[(5-methoxy-3-pyridinyl)sulfamoyl]-N-propan-2-ylbenzamide is COc1cncc(NS(=O)(=O)c2ccccc2C(=O)N(CCO)C(C)C)c1.
What is the InChIKey of N-(2-hydroxyethyl)-2-[(5-methoxy-3-pyridinyl)sulfamoyl]-N-propan-2-ylbenzamide?
The InChIKey is KBSQQVPONNYLST-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N3O5S/c1-13(2)21(8-9-22)18(23)16-6-4-5-7-17(16)27(24,25)20-14-10-15(26-3)12-19-11-14/h4-7,10-13,20,22H,8-9H2,1-3H3.
What are the key properties of N-(2-hydroxyethyl)-2-[(5-methoxy-3-pyridinyl)sulfamoyl]-N-propan-2-ylbenzamide?
N-(2-hydroxyethyl)-2-[(5-methoxy-3-pyridinyl)sulfamoyl]-N-propan-2-ylbenzamide has a molecular weight of 393.47 g/mol, XLogP of 1.73, 8 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxyethyl)-2-[(5-methoxy-3-pyridinyl)sulfamoyl]-N-propan-2-ylbenzamide is sourced from PubChem (CID 58924202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).