1-quinolin-5-ylsulfonylpiperidin-4-amine

C14H17N3O2S — CID 115752090

IUPAC1-quinolin-5-ylsulfonylpiperidin-4-amine
SMILESNC1CCN(S(=O)(=O)c2cccc3ncccc23)CC1
InChIInChI=1S/C14H17N3O2S/c15-11-6-9-17(10-7-11)20(18,19)14-5-1-4-13-12(14)3-2-8-16-13/h1-5,8,11H,6-7,9-10,15H2
InChIKeyHWCANPMVCMKCRU-UHFFFAOYSA-N
MW291.38 g/mol
LogP1.35
Rot. Bonds2

About 1-quinolin-5-ylsulfonylpiperidin-4-amine

1-quinolin-5-ylsulfonylpiperidin-4-amine (PubChem CID 115752090) has the molecular formula C14H17N3O2S and a molecular weight of 291.38 g/mol. Its IUPAC name is 1-quinolin-5-ylsulfonylpiperidin-4-amine.

Molecular Properties

Compound Name1-quinolin-5-ylsulfonylpiperidin-4-amine
PubChem CID115752090
Molecular FormulaC14H17N3O2S
Molecular Weight291.38 g/mol
Exact Mass291.10
IUPAC Name1-quinolin-5-ylsulfonylpiperidin-4-amine
SMILESNC1CCN(S(=O)(=O)c2cccc3ncccc23)CC1
InChIInChI=1S/C14H17N3O2S/c15-11-6-9-17(10-7-11)20(18,19)14-5-1-4-13-12(14)3-2-8-16-13/h1-5,8,11H,6-7,9-10,15H2
InChIKeyHWCANPMVCMKCRU-UHFFFAOYSA-N
XLogP1.35
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 ≤ 51.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-(4-bromopiperidin-1-yl)sulfonylquinoline
CID 104774213
2-(1-quinolin-5-ylsulfonylpyrrolidin-3-yl)ethanamine
CID 114802283
5-(4-methylpiperazin-1-yl)sulfonylquinoline
CID 115599575
2-(1-quinolin-5-ylsulfonylpyrrolidin-3-yl)ethanol
CID 115745017
5-methyl-1-quinolin-5-ylsulfonylpiperidin-3-amine
CID 104774086
5-(1,4-diazepan-1-ylsulfonyl)quinoline;hydrochloride
CID 119963237
3-methyl-1-quinolin-5-ylsulfonylpiperidin-4-one
CID 114500121
3-methyl-1-quinolin-5-ylsulfonylazetidin-3-ol
CID 104773999
(3R)-1-quinolin-8-ylsulfonylpyrrolidin-3-amine
CID 119962398
(1R)-1-[(2R)-1-quinolin-5-ylsulfonylpiperidin-2-yl]ethanamine
CID 125118643
1-isoquinolin-1-ylsulfonylpiperidin-4-amine
CID 67657843
1-(2-fluoro-3-methylphenyl)sulfonylpiperidin-4-amine;hydrochloride
CID 120705953

Frequently Asked Questions

What is the IUPAC name of 1-quinolin-5-ylsulfonylpiperidin-4-amine?
The IUPAC name of 1-quinolin-5-ylsulfonylpiperidin-4-amine (CID 115752090) is 1-quinolin-5-ylsulfonylpiperidin-4-amine.
What is the SMILES notation for 1-quinolin-5-ylsulfonylpiperidin-4-amine?
The canonical SMILES for 1-quinolin-5-ylsulfonylpiperidin-4-amine is NC1CCN(S(=O)(=O)c2cccc3ncccc23)CC1.
What is the InChIKey of 1-quinolin-5-ylsulfonylpiperidin-4-amine?
The InChIKey is HWCANPMVCMKCRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O2S/c15-11-6-9-17(10-7-11)20(18,19)14-5-1-4-13-12(14)3-2-8-16-13/h1-5,8,11H,6-7,9-10,15H2.
What are the key properties of 1-quinolin-5-ylsulfonylpiperidin-4-amine?
1-quinolin-5-ylsulfonylpiperidin-4-amine has a molecular weight of 291.38 g/mol, XLogP of 1.35, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-quinolin-5-ylsulfonylpiperidin-4-amine is sourced from PubChem (CID 115752090), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).