N-(6-hydroxyhexyl)quinoline-5-sulfonamide

C15H20N2O3S — CID 103918476

IUPACN-(6-hydroxyhexyl)quinoline-5-sulfonamide
SMILESO=S(=O)(NCCCCCCO)c1cccc2ncccc12
InChIInChI=1S/C15H20N2O3S/c18-12-4-2-1-3-11-17-21(19,20)15-9-5-8-14-13(15)7-6-10-16-14/h5-10,17-18H,1-4,11-12H2
InChIKeyDWGYTAZHWYCCHW-UHFFFAOYSA-N
MW308.40 g/mol
LogP2.07
Rot. Bonds8

About N-(6-hydroxyhexyl)quinoline-5-sulfonamide

N-(6-hydroxyhexyl)quinoline-5-sulfonamide (PubChem CID 103918476) has the molecular formula C15H20N2O3S and a molecular weight of 308.40 g/mol. Its IUPAC name is N-(6-hydroxyhexyl)quinoline-5-sulfonamide.

Molecular Properties

Compound NameN-(6-hydroxyhexyl)quinoline-5-sulfonamide
PubChem CID103918476
Molecular FormulaC15H20N2O3S
Molecular Weight308.40 g/mol
Exact Mass308.12
IUPAC NameN-(6-hydroxyhexyl)quinoline-5-sulfonamide
SMILESO=S(=O)(NCCCCCCO)c1cccc2ncccc12
InChIInChI=1S/C15H20N2O3S/c18-12-4-2-1-3-11-17-21(19,20)15-9-5-8-14-13(15)7-6-10-16-14/h5-10,17-18H,1-4,11-12H2
InChIKeyDWGYTAZHWYCCHW-UHFFFAOYSA-N
XLogP2.07
TPSA79.29 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.40
LogP ≤ 52.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

4-(quinolin-5-ylsulfonylamino)butanethioamide
CID 104773649
N-[3-(propan-2-ylamino)propyl]quinoline-5-sulfonamide
CID 115752345
N-(pyrimidin-2-ylmethyl)quinoline-5-sulfonamide
CID 166368628
N-(3-chlorobutyl)quinoline-5-sulfonamide
CID 113451724
N-(2-ethyl-4-hydroxybutyl)quinoline-5-sulfonamide
CID 115701460
N-[[1-(2-hydroxyethyl)cyclopropyl]methyl]quinoline-5-sulfonamide
CID 114749841
N-(1,3-dihydroxypropan-2-yl)quinoline-5-sulfonamide
CID 115755300
(2S)-4-hydroxy-2-(quinolin-5-ylsulfonylamino)butanoic acid
CID 104934981
N-(1-hydroxy-4-methylpentan-3-yl)quinoline-5-sulfonamide
CID 103836279
(2R)-4-hydroxy-2-(quinolin-5-ylsulfonylamino)butanoic acid
CID 104933783
N-[(3R)-1-hydroxypentan-3-yl]quinoline-5-sulfonamide
CID 97096071
N-(3-amino-4-methoxybutyl)quinoline-5-sulfonamide
CID 106243751

Frequently Asked Questions

What is the IUPAC name of N-(6-hydroxyhexyl)quinoline-5-sulfonamide?
The IUPAC name of N-(6-hydroxyhexyl)quinoline-5-sulfonamide (CID 103918476) is N-(6-hydroxyhexyl)quinoline-5-sulfonamide.
What is the SMILES notation for N-(6-hydroxyhexyl)quinoline-5-sulfonamide?
The canonical SMILES for N-(6-hydroxyhexyl)quinoline-5-sulfonamide is O=S(=O)(NCCCCCCO)c1cccc2ncccc12.
What is the InChIKey of N-(6-hydroxyhexyl)quinoline-5-sulfonamide?
The InChIKey is DWGYTAZHWYCCHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O3S/c18-12-4-2-1-3-11-17-21(19,20)15-9-5-8-14-13(15)7-6-10-16-14/h5-10,17-18H,1-4,11-12H2.
What are the key properties of N-(6-hydroxyhexyl)quinoline-5-sulfonamide?
N-(6-hydroxyhexyl)quinoline-5-sulfonamide has a molecular weight of 308.40 g/mol, XLogP of 2.07, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-hydroxyhexyl)quinoline-5-sulfonamide is sourced from PubChem (CID 103918476), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).