6-(3,4-dimethylpyrrolidin-1-yl)sulfonylquinolin-2-amine

C15H19N3O2S — CID 79179415

IUPAC6-(3,4-dimethylpyrrolidin-1-yl)sulfonylquinolin-2-amine
SMILESCC1CN(S(=O)(=O)c2ccc3nc(N)ccc3c2)CC1C
InChIInChI=1S/C15H19N3O2S/c1-10-8-18(9-11(10)2)21(19,20)13-4-5-14-12(7-13)3-6-15(16)17-14/h3-7,10-11H,8-9H2,1-2H3,(H2,16,17)
InChIKeyAVTDLJGMPMZVJL-UHFFFAOYSA-N
MW305.40 g/mol
LogP2.09
Rot. Bonds2

About 6-(3,4-dimethylpyrrolidin-1-yl)sulfonylquinolin-2-amine

6-(3,4-dimethylpyrrolidin-1-yl)sulfonylquinolin-2-amine (PubChem CID 79179415) has the molecular formula C15H19N3O2S and a molecular weight of 305.40 g/mol. Its IUPAC name is 6-(3,4-dimethylpyrrolidin-1-yl)sulfonylquinolin-2-amine.

Molecular Properties

Compound Name6-(3,4-dimethylpyrrolidin-1-yl)sulfonylquinolin-2-amine
PubChem CID79179415
Molecular FormulaC15H19N3O2S
Molecular Weight305.40 g/mol
Exact Mass305.12
IUPAC Name6-(3,4-dimethylpyrrolidin-1-yl)sulfonylquinolin-2-amine
SMILESCC1CN(S(=O)(=O)c2ccc3nc(N)ccc3c2)CC1C
InChIInChI=1S/C15H19N3O2S/c1-10-8-18(9-11(10)2)21(19,20)13-4-5-14-12(7-13)3-6-15(16)17-14/h3-7,10-11H,8-9H2,1-2H3,(H2,16,17)
InChIKeyAVTDLJGMPMZVJL-UHFFFAOYSA-N
XLogP2.09
TPSA76.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.40
LogP ≤ 52.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-(3-methoxypyrrolidin-1-yl)sulfonylquinolin-2-amine
CID 103538322
1-(2-aminoquinolin-6-yl)sulfonylpiperidin-4-ol
CID 62143522
6-(2-methylpyrrolidin-1-yl)sulfonylquinolin-2-amine
CID 62162789
4-(3,4-dimethylpyrrolidin-1-yl)sulfonyl-2-fluoroaniline
CID 82844575
2-amino-N-(3-methylbutyl)quinoline-6-sulfonamide
CID 62149054
2-amino-N-(2,2-dimethylpropyl)-N-methylquinoline-6-sulfonamide
CID 62152213
2-chloro-6-(3-methoxypyrrolidin-1-yl)sulfonylquinoline
CID 103532783
2-chloro-4-(3,4-dimethylpyrrolidin-1-yl)sulfonylpyridine
CID 79183789
6-[[(1R,5S)-3-azabicyclo[3.2.0]heptan-3-yl]sulfonyl]quinoline
CID 167907378
(2S,6S)-2,6-dimethyl-4-naphthalen-2-ylsulfonylmorpholine
CID 704067
3-chloro-5-(3,4-dimethylpyrrolidin-1-yl)sulfonylpyridin-2-amine
CID 79180594
3-(3,4-dimethylpyrrolidin-1-yl)sulfonylbenzoic acid
CID 79189026

Frequently Asked Questions

What is the IUPAC name of 6-(3,4-dimethylpyrrolidin-1-yl)sulfonylquinolin-2-amine?
The IUPAC name of 6-(3,4-dimethylpyrrolidin-1-yl)sulfonylquinolin-2-amine (CID 79179415) is 6-(3,4-dimethylpyrrolidin-1-yl)sulfonylquinolin-2-amine.
What is the SMILES notation for 6-(3,4-dimethylpyrrolidin-1-yl)sulfonylquinolin-2-amine?
The canonical SMILES for 6-(3,4-dimethylpyrrolidin-1-yl)sulfonylquinolin-2-amine is CC1CN(S(=O)(=O)c2ccc3nc(N)ccc3c2)CC1C.
What is the InChIKey of 6-(3,4-dimethylpyrrolidin-1-yl)sulfonylquinolin-2-amine?
The InChIKey is AVTDLJGMPMZVJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O2S/c1-10-8-18(9-11(10)2)21(19,20)13-4-5-14-12(7-13)3-6-15(16)17-14/h3-7,10-11H,8-9H2,1-2H3,(H2,16,17).
What are the key properties of 6-(3,4-dimethylpyrrolidin-1-yl)sulfonylquinolin-2-amine?
6-(3,4-dimethylpyrrolidin-1-yl)sulfonylquinolin-2-amine has a molecular weight of 305.40 g/mol, XLogP of 2.09, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3,4-dimethylpyrrolidin-1-yl)sulfonylquinolin-2-amine is sourced from PubChem (CID 79179415), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).