N-(2-amino-1-cyclopentylethyl)quinoline-8-sulfonamide;hydrochloride

C16H22ClN3O2S — CID 120584995

IUPACN-(2-amino-1-cyclopentylethyl)quinoline-8-sulfonamide;hydrochloride
SMILESCl.NCC(NS(=O)(=O)c1cccc2cccnc12)C1CCCC1
InChIInChI=1S/C16H21N3O2S.ClH/c17-11-14(12-5-1-2-6-12)19-22(20,21)15-9-3-7-13-8-4-10-18-16(13)15;/h3-4,7-10,12,14,19H,1-2,5-6,11,17H2;1H
InChIKeyXWRYFMGJTDBFAI-UHFFFAOYSA-N
MW355.89 g/mol
LogP2.45
Rot. Bonds5

About N-(2-amino-1-cyclopentylethyl)quinoline-8-sulfonamide;hydrochloride

N-(2-amino-1-cyclopentylethyl)quinoline-8-sulfonamide;hydrochloride (PubChem CID 120584995) has the molecular formula C16H22ClN3O2S and a molecular weight of 355.89 g/mol. Its IUPAC name is N-(2-amino-1-cyclopentylethyl)quinoline-8-sulfonamide;hydrochloride.

Molecular Properties

Compound NameN-(2-amino-1-cyclopentylethyl)quinoline-8-sulfonamide;hydrochloride
PubChem CID120584995
Molecular FormulaC16H22ClN3O2S
Molecular Weight355.89 g/mol
Exact Mass355.11
IUPAC NameN-(2-amino-1-cyclopentylethyl)quinoline-8-sulfonamide;hydrochloride
SMILESCl.NCC(NS(=O)(=O)c1cccc2cccnc12)C1CCCC1
InChIInChI=1S/C16H21N3O2S.ClH/c17-11-14(12-5-1-2-6-12)19-22(20,21)15-9-3-7-13-8-4-10-18-16(13)15;/h3-4,7-10,12,14,19H,1-2,5-6,11,17H2;1H
InChIKeyXWRYFMGJTDBFAI-UHFFFAOYSA-N
XLogP2.45
TPSA85.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.89
LogP ≤ 52.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-amino-1-cyclopentylethyl)-3-methylquinoline-8-sulfonamide
CID 120585099
N-(2-amino-1-cyclopentylethyl)-8-methylquinoline-5-sulfonamide
CID 120585095
N-(2-amino-1-cyclopropylethyl)-3-methylquinoline-8-sulfonamide;hydrochloride
CID 119986825
N-(2-amino-1-cyclohexylethyl)-2-cyanopyridine-3-sulfonamide
CID 106598645
N-cycloheptylquinoline-8-sulfonamide
CID 3244108
N-(2-amino-1-cyclopentylethyl)-2,3-dichlorobenzenesulfonamide
CID 106737809
N-[(2S)-1-amino-4-methylpentan-2-yl]quinoline-8-sulfonamide
CID 97238593
N-(2-amino-1-cyclopentylethyl)-3-fluoropyridine-2-sulfonamide
CID 106737928
N-(2-amino-1-cyclopentylethyl)-2-bromo-3-methylbenzenesulfonamide;hydrochloride
CID 120585153
methyl 2-[(2-amino-1-cyclohexylethyl)sulfamoyl]benzoate;hydrochloride
CID 119983872
methyl 3-[(2-amino-1-cyclopentylethyl)sulfamoyl]-2-methylbenzoate
CID 120585227
N-(2-amino-1-cyclohexylethyl)-1H-pyrazole-5-sulfonamide
CID 102690413

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-1-cyclopentylethyl)quinoline-8-sulfonamide;hydrochloride?
The IUPAC name of N-(2-amino-1-cyclopentylethyl)quinoline-8-sulfonamide;hydrochloride (CID 120584995) is N-(2-amino-1-cyclopentylethyl)quinoline-8-sulfonamide;hydrochloride.
What is the SMILES notation for N-(2-amino-1-cyclopentylethyl)quinoline-8-sulfonamide;hydrochloride?
The canonical SMILES for N-(2-amino-1-cyclopentylethyl)quinoline-8-sulfonamide;hydrochloride is Cl.NCC(NS(=O)(=O)c1cccc2cccnc12)C1CCCC1.
What is the InChIKey of N-(2-amino-1-cyclopentylethyl)quinoline-8-sulfonamide;hydrochloride?
The InChIKey is XWRYFMGJTDBFAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N3O2S.ClH/c17-11-14(12-5-1-2-6-12)19-22(20,21)15-9-3-7-13-8-4-10-18-16(13)15;/h3-4,7-10,12,14,19H,1-2,5-6,11,17H2;1H.
What are the key properties of N-(2-amino-1-cyclopentylethyl)quinoline-8-sulfonamide;hydrochloride?
N-(2-amino-1-cyclopentylethyl)quinoline-8-sulfonamide;hydrochloride has a molecular weight of 355.89 g/mol, XLogP of 2.45, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-1-cyclopentylethyl)quinoline-8-sulfonamide;hydrochloride is sourced from PubChem (CID 120584995), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).