6-(2-methylpyrrolidin-1-yl)sulfonylquinolin-2-amine

C14H17N3O2S — CID 62162789

IUPAC6-(2-methylpyrrolidin-1-yl)sulfonylquinolin-2-amine
SMILESCC1CCCN1S(=O)(=O)c1ccc2nc(N)ccc2c1
InChIInChI=1S/C14H17N3O2S/c1-10-3-2-8-17(10)20(18,19)12-5-6-13-11(9-12)4-7-14(15)16-13/h4-7,9-10H,2-3,8H2,1H3,(H2,15,16)
InChIKeyKRXPAKQFHMIARC-UHFFFAOYSA-N
MW291.38 g/mol
LogP1.99
Rot. Bonds2

About 6-(2-methylpyrrolidin-1-yl)sulfonylquinolin-2-amine

6-(2-methylpyrrolidin-1-yl)sulfonylquinolin-2-amine (PubChem CID 62162789) has the molecular formula C14H17N3O2S and a molecular weight of 291.38 g/mol. Its IUPAC name is 6-(2-methylpyrrolidin-1-yl)sulfonylquinolin-2-amine.

Molecular Properties

Compound Name6-(2-methylpyrrolidin-1-yl)sulfonylquinolin-2-amine
PubChem CID62162789
Molecular FormulaC14H17N3O2S
Molecular Weight291.38 g/mol
Exact Mass291.10
IUPAC Name6-(2-methylpyrrolidin-1-yl)sulfonylquinolin-2-amine
SMILESCC1CCCN1S(=O)(=O)c1ccc2nc(N)ccc2c1
InChIInChI=1S/C14H17N3O2S/c1-10-3-2-8-17(10)20(18,19)12-5-6-13-11(9-12)4-7-14(15)16-13/h4-7,9-10H,2-3,8H2,1H3,(H2,15,16)
InChIKeyKRXPAKQFHMIARC-UHFFFAOYSA-N
XLogP1.99
TPSA76.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.38
LogP ≤ 51.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-[(2R)-2-methylpiperidin-1-yl]sulfonyl-2-piperidin-1-ylquinoline
CID 92887045
2-(azepan-1-yl)-6-[(2S)-2-methylpiperidin-1-yl]sulfonylquinoline
CID 92864402
2-(azepan-1-yl)-6-(2-methylpiperidin-1-yl)sulfonylquinoline
CID 46283450
6-(3,4-dimethylpyrrolidin-1-yl)sulfonylquinolin-2-amine
CID 79179415
2-methyl-5-(2-methylpyrrolidin-1-yl)sulfonylaniline
CID 54881931
2-methyl-1-naphthalen-2-ylsulfonylpiperidine
CID 3745150
2-(2,3-dihydroindol-1-yl)-6-[(2R)-2-methylpiperidin-1-yl]sulfonylquinoline
CID 92887015
1-(2-aminoquinolin-6-yl)sulfonylpiperidin-4-ol
CID 62143522
2-fluoro-5-(2-methylpyrrolidin-1-yl)sulfonylaniline
CID 54882062
3-[(2S)-2-methylpyrrolidin-1-yl]sulfonylaniline
CID 93391248
3-(2-methylpyrrolidin-1-yl)sulfonylaniline
CID 60973434
6-(3-methoxypyrrolidin-1-yl)sulfonylquinolin-2-amine
CID 103538322

Frequently Asked Questions

What is the IUPAC name of 6-(2-methylpyrrolidin-1-yl)sulfonylquinolin-2-amine?
The IUPAC name of 6-(2-methylpyrrolidin-1-yl)sulfonylquinolin-2-amine (CID 62162789) is 6-(2-methylpyrrolidin-1-yl)sulfonylquinolin-2-amine.
What is the SMILES notation for 6-(2-methylpyrrolidin-1-yl)sulfonylquinolin-2-amine?
The canonical SMILES for 6-(2-methylpyrrolidin-1-yl)sulfonylquinolin-2-amine is CC1CCCN1S(=O)(=O)c1ccc2nc(N)ccc2c1.
What is the InChIKey of 6-(2-methylpyrrolidin-1-yl)sulfonylquinolin-2-amine?
The InChIKey is KRXPAKQFHMIARC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O2S/c1-10-3-2-8-17(10)20(18,19)12-5-6-13-11(9-12)4-7-14(15)16-13/h4-7,9-10H,2-3,8H2,1H3,(H2,15,16).
What are the key properties of 6-(2-methylpyrrolidin-1-yl)sulfonylquinolin-2-amine?
6-(2-methylpyrrolidin-1-yl)sulfonylquinolin-2-amine has a molecular weight of 291.38 g/mol, XLogP of 1.99, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-methylpyrrolidin-1-yl)sulfonylquinolin-2-amine is sourced from PubChem (CID 62162789), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).