N-(4-benzoyl-3-pyridinyl)-4-propan-2-yloxybenzenesulfonamide

C21H20N2O4S — CID 46833310

IUPACN-(4-benzoyl-3-pyridinyl)-4-propan-2-yloxybenzenesulfonamide
SMILESCC(C)Oc1ccc(S(=O)(=O)Nc2cnccc2C(=O)c2ccccc2)cc1
InChIInChI=1S/C21H20N2O4S/c1-15(2)27-17-8-10-18(11-9-17)28(25,26)23-20-14-22-13-12-19(20)21(24)16-6-4-3-5-7-16/h3-15,23H,1-2H3
InChIKeySVFDLTIXMPSAST-UHFFFAOYSA-N
MW396.47 g/mol
LogP3.90
Rot. Bonds7

About N-(4-benzoyl-3-pyridinyl)-4-propan-2-yloxybenzenesulfonamide

N-(4-benzoyl-3-pyridinyl)-4-propan-2-yloxybenzenesulfonamide (PubChem CID 46833310) has the molecular formula C21H20N2O4S and a molecular weight of 396.47 g/mol. Its IUPAC name is N-(4-benzoyl-3-pyridinyl)-4-propan-2-yloxybenzenesulfonamide.

Molecular Properties

Compound NameN-(4-benzoyl-3-pyridinyl)-4-propan-2-yloxybenzenesulfonamide
PubChem CID46833310
Molecular FormulaC21H20N2O4S
Molecular Weight396.47 g/mol
Exact Mass396.11
IUPAC NameN-(4-benzoyl-3-pyridinyl)-4-propan-2-yloxybenzenesulfonamide
SMILESCC(C)Oc1ccc(S(=O)(=O)Nc2cnccc2C(=O)c2ccccc2)cc1
InChIInChI=1S/C21H20N2O4S/c1-15(2)27-17-8-10-18(11-9-17)28(25,26)23-20-14-22-13-12-19(20)21(24)16-6-4-3-5-7-16/h3-15,23H,1-2H3
InChIKeySVFDLTIXMPSAST-UHFFFAOYSA-N
XLogP3.90
TPSA85.36 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500396.47
LogP ≤ 53.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-(4-benzoyl-3-pyridinyl)-4-propan-2-yloxybenzenesulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(3-benzoyl-5-methyl-2-pyridinyl)-4-propan-2-yloxybenzenesulfonamide
CID 70834325
N-[2-[(4-propan-2-yloxyphenyl)sulfonylamino]phenyl]acetamide
CID 113093731
methyl 2-[(4-propan-2-yloxyphenyl)sulfonylamino]benzoate
CID 110756559
N-[4-chloro-2-(3-chlorobenzoyl)phenyl]-4-propan-2-yloxybenzenesulfonamide
CID 10073118
4-ethoxy-N-[2-(pyridine-4-carbonyl)-4-(trifluoromethyl)phenyl]benzenesulfonamide;4-propan-2-yloxy-N-[2-(pyridine-4-carbonyl)-4-(trifluoromethyl)phenyl]benzenesulfonamide
CID 160579287
N-(2-benzoyl-5-bromophenyl)-4-methoxybenzenesulfonamide
CID 11212994
N-[3-(1-benzofuran-2-carbonyl)-5-chloro-2-pyridinyl]-4-propan-2-yloxybenzenesulfonamide;N-(3-benzoyl-5-chloro-2-pyridinyl)-5-(furan-2-yl)thiophene-2-sulfonamide;N-(3-benzoyl-5-chloro-2-pyridinyl)-4-propan-2-ylbenzenesulfonamide;N-(3-benzoyl-5-nitro-2-pyridinyl)-4-propan-2-yloxybenzenesulfonamide;N-(4-benzoyl-3-pyridinyl)-4-propan-2-ylbenzenesulfonamide;N-(3-benzoyl-4-pyridinyl)-4-propan-2-yloxybenzenesulfonamide
CID 160763816
N-(2-benzoylphenyl)-4-tert-butylbenzenesulfonamide
CID 10883729
N-(4-methylphenyl)-3-[(4-methylphenyl)sulfonylamino]pyridine-4-carboxamide
CID 70789421
N-(2-methyl-4-propan-2-yloxyphenyl)-4-(phenylsulfamoyl)benzamide
CID 55945032
4-propan-2-yloxy-N-quinolin-3-ylbenzenesulfonamide
CID 110730295
(2R)-N-methyl-2-[4-(phenylsulfamoyl)phenoxy]propanamide
CID 92513136

Frequently Asked Questions

What is the IUPAC name of N-(4-benzoyl-3-pyridinyl)-4-propan-2-yloxybenzenesulfonamide?
The IUPAC name of N-(4-benzoyl-3-pyridinyl)-4-propan-2-yloxybenzenesulfonamide (CID 46833310) is N-(4-benzoyl-3-pyridinyl)-4-propan-2-yloxybenzenesulfonamide.
What is the SMILES notation for N-(4-benzoyl-3-pyridinyl)-4-propan-2-yloxybenzenesulfonamide?
The canonical SMILES for N-(4-benzoyl-3-pyridinyl)-4-propan-2-yloxybenzenesulfonamide is CC(C)Oc1ccc(S(=O)(=O)Nc2cnccc2C(=O)c2ccccc2)cc1.
What is the InChIKey of N-(4-benzoyl-3-pyridinyl)-4-propan-2-yloxybenzenesulfonamide?
The InChIKey is SVFDLTIXMPSAST-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20N2O4S/c1-15(2)27-17-8-10-18(11-9-17)28(25,26)23-20-14-22-13-12-19(20)21(24)16-6-4-3-5-7-16/h3-15,23H,1-2H3.
What are the key properties of N-(4-benzoyl-3-pyridinyl)-4-propan-2-yloxybenzenesulfonamide?
N-(4-benzoyl-3-pyridinyl)-4-propan-2-yloxybenzenesulfonamide has a molecular weight of 396.47 g/mol, XLogP of 3.90, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-benzoyl-3-pyridinyl)-4-propan-2-yloxybenzenesulfonamide is sourced from PubChem (CID 46833310), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).