N-(2-methoxy-3-pyridinyl)-2-methyl-5-(2-oxopyrrolidin-1-yl)benzenesulfonamide

C17H19N3O4S — CID 46966844

IUPACN-(2-methoxy-3-pyridinyl)-2-methyl-5-(2-oxopyrrolidin-1-yl)benzenesulfonamide
SMILESCOc1ncccc1NS(=O)(=O)c1cc(N2CCCC2=O)ccc1C
InChIInChI=1S/C17H19N3O4S/c1-12-7-8-13(20-10-4-6-16(20)21)11-15(12)25(22,23)19-14-5-3-9-18-17(14)24-2/h3,5,7-9,11,19H,4,6,10H2,1-2H3
InChIKeyIPAQHSHJXNNZIJ-UHFFFAOYSA-N
MW361.42 g/mol
LogP2.33
Rot. Bonds5

About N-(2-methoxy-3-pyridinyl)-2-methyl-5-(2-oxopyrrolidin-1-yl)benzenesulfonamide

N-(2-methoxy-3-pyridinyl)-2-methyl-5-(2-oxopyrrolidin-1-yl)benzenesulfonamide (PubChem CID 46966844) has the molecular formula C17H19N3O4S and a molecular weight of 361.42 g/mol. Its IUPAC name is N-(2-methoxy-3-pyridinyl)-2-methyl-5-(2-oxopyrrolidin-1-yl)benzenesulfonamide.

Molecular Properties

Compound NameN-(2-methoxy-3-pyridinyl)-2-methyl-5-(2-oxopyrrolidin-1-yl)benzenesulfonamide
PubChem CID46966844
Molecular FormulaC17H19N3O4S
Molecular Weight361.42 g/mol
Exact Mass361.11
IUPAC NameN-(2-methoxy-3-pyridinyl)-2-methyl-5-(2-oxopyrrolidin-1-yl)benzenesulfonamide
SMILESCOc1ncccc1NS(=O)(=O)c1cc(N2CCCC2=O)ccc1C
InChIInChI=1S/C17H19N3O4S/c1-12-7-8-13(20-10-4-6-16(20)21)11-15(12)25(22,23)19-14-5-3-9-18-17(14)24-2/h3,5,7-9,11,19H,4,6,10H2,1-2H3
InChIKeyIPAQHSHJXNNZIJ-UHFFFAOYSA-N
XLogP2.33
TPSA88.60 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.42
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2-ethoxyphenyl)-2-methyl-4-(2-oxopyrrolidin-1-yl)benzenesulfonamide
CID 86848405
4-methoxy-2,5-dimethyl-N-[3-(2-oxopyrrolidin-1-yl)phenyl]benzenesulfonamide
CID 7635954
N-(2-chloro-4-methoxyphenyl)-2-methyl-4-(2-oxopyrrolidin-1-yl)benzenesulfonamide
CID 86858451
N-[1-(4-methoxyphenyl)cyclopropyl]-2-methyl-5-(2-oxopyrrolidin-1-yl)benzenesulfonamide
CID 16676310
methyl 4-methyl-3-[[4-(2-oxopyrrolidin-1-yl)phenyl]sulfamoyl]benzoate
CID 35530952
N-[(1R,6R)-7-bicyclo[4.1.0]heptanyl]-2-methyl-5-(2-oxopyrrolidin-1-yl)benzenesulfonamide
CID 98137630
2-methyl-5-(2-oxopyrrolidin-1-yl)-N-(1-phenylcyclopropyl)benzenesulfonamide
CID 16673933
2-methoxy-N-(3-methoxyphenyl)-5-(2-oxopyrrolidin-1-yl)benzenesulfonamide
CID 110295704
4-bromo-N-(2-methoxy-3-pyridinyl)-3-methylbenzenesulfonamide
CID 47038316
N-[(1S)-1-[3-[[2-methyl-5-(2-oxopyrrolidin-1-yl)phenyl]sulfonylamino]phenyl]ethyl]acetamide
CID 25300845
3,4-dimethyl-N-[2-(2-oxopyrrolidin-1-yl)phenyl]benzenesulfonamide
CID 8841739
2-methoxy-N-[1-[3-(2-oxopyrrolidin-1-yl)phenyl]ethyl]pyridine-3-carboxamide
CID 60590019

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxy-3-pyridinyl)-2-methyl-5-(2-oxopyrrolidin-1-yl)benzenesulfonamide?
The IUPAC name of N-(2-methoxy-3-pyridinyl)-2-methyl-5-(2-oxopyrrolidin-1-yl)benzenesulfonamide (CID 46966844) is N-(2-methoxy-3-pyridinyl)-2-methyl-5-(2-oxopyrrolidin-1-yl)benzenesulfonamide.
What is the SMILES notation for N-(2-methoxy-3-pyridinyl)-2-methyl-5-(2-oxopyrrolidin-1-yl)benzenesulfonamide?
The canonical SMILES for N-(2-methoxy-3-pyridinyl)-2-methyl-5-(2-oxopyrrolidin-1-yl)benzenesulfonamide is COc1ncccc1NS(=O)(=O)c1cc(N2CCCC2=O)ccc1C.
What is the InChIKey of N-(2-methoxy-3-pyridinyl)-2-methyl-5-(2-oxopyrrolidin-1-yl)benzenesulfonamide?
The InChIKey is IPAQHSHJXNNZIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3O4S/c1-12-7-8-13(20-10-4-6-16(20)21)11-15(12)25(22,23)19-14-5-3-9-18-17(14)24-2/h3,5,7-9,11,19H,4,6,10H2,1-2H3.
What are the key properties of N-(2-methoxy-3-pyridinyl)-2-methyl-5-(2-oxopyrrolidin-1-yl)benzenesulfonamide?
N-(2-methoxy-3-pyridinyl)-2-methyl-5-(2-oxopyrrolidin-1-yl)benzenesulfonamide has a molecular weight of 361.42 g/mol, XLogP of 2.33, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxy-3-pyridinyl)-2-methyl-5-(2-oxopyrrolidin-1-yl)benzenesulfonamide is sourced from PubChem (CID 46966844), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).