(3R)-1-quinolin-8-ylsulfonylpyrrolidin-3-amine

C13H15N3O2S — CID 119962398

IUPAC(3R)-1-quinolin-8-ylsulfonylpyrrolidin-3-amine
SMILESN[C@@H]1CCN(S(=O)(=O)c2cccc3cccnc23)C1
InChIInChI=1S/C13H15N3O2S/c14-11-6-8-16(9-11)19(17,18)12-5-1-3-10-4-2-7-15-13(10)12/h1-5,7,11H,6,8-9,14H2/t11-/m1/s1
InChIKeyUZWAIPRFLVPKIF-LLVKDONJSA-N
MW277.35 g/mol
LogP0.96
Rot. Bonds2

About (3R)-1-quinolin-8-ylsulfonylpyrrolidin-3-amine

(3R)-1-quinolin-8-ylsulfonylpyrrolidin-3-amine (PubChem CID 119962398) has the molecular formula C13H15N3O2S and a molecular weight of 277.35 g/mol. Its IUPAC name is (3R)-1-quinolin-8-ylsulfonylpyrrolidin-3-amine.

Molecular Properties

Compound Name(3R)-1-quinolin-8-ylsulfonylpyrrolidin-3-amine
PubChem CID119962398
Molecular FormulaC13H15N3O2S
Molecular Weight277.35 g/mol
Exact Mass277.09
IUPAC Name(3R)-1-quinolin-8-ylsulfonylpyrrolidin-3-amine
SMILESN[C@@H]1CCN(S(=O)(=O)c2cccc3cccnc23)C1
InChIInChI=1S/C13H15N3O2S/c14-11-6-8-16(9-11)19(17,18)12-5-1-3-10-4-2-7-15-13(10)12/h1-5,7,11H,6,8-9,14H2/t11-/m1/s1
InChIKeyUZWAIPRFLVPKIF-LLVKDONJSA-N
XLogP0.96
TPSA76.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.35
LogP ≤ 50.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze (3R)-1-quinolin-8-ylsulfonylpyrrolidin-3-amine 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-methyl-1-(1-quinolin-8-ylsulfonylpyrrolidin-3-yl)methanamine
CID 119977492
8-(4-quinolin-8-ylsulfonylpiperazin-1-yl)sulfonylquinoline
CID 4173018
1-(1-quinolin-8-ylsulfonylpiperidin-4-yl)ethanamine
CID 119974617
8-(4-pyrrol-1-ylpiperidin-1-yl)sulfonylquinoline
CID 2809715
8-[4-(pyridin-2-ylmethyl)piperidin-1-yl]sulfonylquinoline
CID 99816764
8-(3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-ylsulfonyl)quinoline
CID 22202524
8-piperidin-1-ylsulfonylquinoline
CID 768759
N-methyl-1-(1-quinolin-8-ylsulfonylpiperidin-3-yl)methanamine
CID 119960917
1-isoquinolin-5-ylsulfonylpyrrolidin-3-amine;hydrochloride
CID 119971621
N-[(1-quinolin-8-ylsulfonylpiperidin-4-yl)methyl]ethanamine;hydrochloride
CID 119990230
8-[4-[(4-methylpiperidin-1-yl)methyl]piperidin-1-yl]sulfonylquinoline
CID 20930309
3-[(3R)-1-quinolin-8-ylsulfonylpyrrolidin-3-yl]-1,3-thiazolidine-2,4-dione
CID 99991977

Frequently Asked Questions

What is the IUPAC name of (3R)-1-quinolin-8-ylsulfonylpyrrolidin-3-amine?
The IUPAC name of (3R)-1-quinolin-8-ylsulfonylpyrrolidin-3-amine (CID 119962398) is (3R)-1-quinolin-8-ylsulfonylpyrrolidin-3-amine.
What is the SMILES notation for (3R)-1-quinolin-8-ylsulfonylpyrrolidin-3-amine?
The canonical SMILES for (3R)-1-quinolin-8-ylsulfonylpyrrolidin-3-amine is N[C@@H]1CCN(S(=O)(=O)c2cccc3cccnc23)C1.
What is the InChIKey of (3R)-1-quinolin-8-ylsulfonylpyrrolidin-3-amine?
The InChIKey is UZWAIPRFLVPKIF-LLVKDONJSA-N. The full InChI is InChI=1S/C13H15N3O2S/c14-11-6-8-16(9-11)19(17,18)12-5-1-3-10-4-2-7-15-13(10)12/h1-5,7,11H,6,8-9,14H2/t11-/m1/s1.
What are the key properties of (3R)-1-quinolin-8-ylsulfonylpyrrolidin-3-amine?
(3R)-1-quinolin-8-ylsulfonylpyrrolidin-3-amine has a molecular weight of 277.35 g/mol, XLogP of 0.96, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-1-quinolin-8-ylsulfonylpyrrolidin-3-amine is sourced from PubChem (CID 119962398), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).