N,N-dimethyl-3-quinolin-2-yloxypyrrolidine-1-sulfonamide

C15H19N3O3S — CID 91815890

IUPACN,N-dimethyl-3-quinolin-2-yloxypyrrolidine-1-sulfonamide
SMILESCN(C)S(=O)(=O)N1CCC(Oc2ccc3ccccc3n2)C1
InChIInChI=1S/C15H19N3O3S/c1-17(2)22(19,20)18-10-9-13(11-18)21-15-8-7-12-5-3-4-6-14(12)16-15/h3-8,13H,9-11H2,1-2H3
InChIKeyKHNPDFRILYTAOZ-UHFFFAOYSA-N
MW321.40 g/mol
LogP1.49
Rot. Bonds4

About N,N-dimethyl-3-quinolin-2-yloxypyrrolidine-1-sulfonamide

N,N-dimethyl-3-quinolin-2-yloxypyrrolidine-1-sulfonamide (PubChem CID 91815890) has the molecular formula C15H19N3O3S and a molecular weight of 321.40 g/mol. Its IUPAC name is N,N-dimethyl-3-quinolin-2-yloxypyrrolidine-1-sulfonamide.

Molecular Properties

Compound NameN,N-dimethyl-3-quinolin-2-yloxypyrrolidine-1-sulfonamide
PubChem CID91815890
Molecular FormulaC15H19N3O3S
Molecular Weight321.40 g/mol
Exact Mass321.11
IUPAC NameN,N-dimethyl-3-quinolin-2-yloxypyrrolidine-1-sulfonamide
SMILESCN(C)S(=O)(=O)N1CCC(Oc2ccc3ccccc3n2)C1
InChIInChI=1S/C15H19N3O3S/c1-17(2)22(19,20)18-10-9-13(11-18)21-15-8-7-12-5-3-4-6-14(12)16-15/h3-8,13H,9-11H2,1-2H3
InChIKeyKHNPDFRILYTAOZ-UHFFFAOYSA-N
XLogP1.49
TPSA62.74 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.40
LogP ≤ 51.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-[1-[(E)-2-phenylethenyl]sulfonylpyrrolidin-3-yl]oxyquinoline
CID 91815893
N,N-dimethyl-4-quinoxalin-2-yloxypiperidine-1-sulfonamide
CID 90560109
2-[1-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonyl]azetidin-3-yl]oxyquinoline
CID 122250674
N,N-dimethyl-3-[[4-(trifluoromethyl)-2-pyridinyl]oxy]pyrrolidine-1-sulfonamide
CID 91625468
2-[1-(2-phenoxyethylsulfonyl)azetidin-3-yl]oxyquinoline
CID 122250690
(2-chlorophenyl)-(3-quinolin-2-yloxypyrrolidin-1-yl)methanone
CID 91815832
2-[1-[4-(trifluoromethyl)phenyl]sulfonylazetidin-3-yl]oxyquinoline
CID 122250651
1-[3-(3-quinolin-2-yloxyazetidin-1-yl)sulfonylphenyl]ethanone
CID 122250642
pyridin-2-yl-(3-quinolin-2-yloxypyrrolidin-1-yl)methanone
CID 91815849
(3S)-N,N-dimethyl-3-(6-morpholin-4-ylpyrimidin-4-yl)oxypyrrolidine-1-sulfonamide
CID 95108130
N,N-dimethyl-3-[[6-(trifluoromethyl)-2-pyridinyl]oxy]azetidine-1-sulfonamide
CID 122252108
(3-fluoro-4-methoxyphenyl)-(3-quinolin-2-yloxypyrrolidin-1-yl)methanone
CID 91815865

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-3-quinolin-2-yloxypyrrolidine-1-sulfonamide?
The IUPAC name of N,N-dimethyl-3-quinolin-2-yloxypyrrolidine-1-sulfonamide (CID 91815890) is N,N-dimethyl-3-quinolin-2-yloxypyrrolidine-1-sulfonamide.
What is the SMILES notation for N,N-dimethyl-3-quinolin-2-yloxypyrrolidine-1-sulfonamide?
The canonical SMILES for N,N-dimethyl-3-quinolin-2-yloxypyrrolidine-1-sulfonamide is CN(C)S(=O)(=O)N1CCC(Oc2ccc3ccccc3n2)C1.
What is the InChIKey of N,N-dimethyl-3-quinolin-2-yloxypyrrolidine-1-sulfonamide?
The InChIKey is KHNPDFRILYTAOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O3S/c1-17(2)22(19,20)18-10-9-13(11-18)21-15-8-7-12-5-3-4-6-14(12)16-15/h3-8,13H,9-11H2,1-2H3.
What are the key properties of N,N-dimethyl-3-quinolin-2-yloxypyrrolidine-1-sulfonamide?
N,N-dimethyl-3-quinolin-2-yloxypyrrolidine-1-sulfonamide has a molecular weight of 321.40 g/mol, XLogP of 1.49, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-3-quinolin-2-yloxypyrrolidine-1-sulfonamide is sourced from PubChem (CID 91815890), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).