N-(2-hydroxyethyl)quinoline-8-sulfonamide

C11H12N2O3S — CID 5056828

IUPACN-(2-hydroxyethyl)quinoline-8-sulfonamide
SMILESO=S(=O)(NCCO)c1cccc2cccnc12
InChIInChI=1S/C11H12N2O3S/c14-8-7-13-17(15,16)10-5-1-3-9-4-2-6-12-11(9)10/h1-6,13-14H,7-8H2
InChIKeyDQTXAXKQLOODEX-UHFFFAOYSA-N
MW252.29 g/mol
LogP0.51
Rot. Bonds4

About N-(2-hydroxyethyl)quinoline-8-sulfonamide

N-(2-hydroxyethyl)quinoline-8-sulfonamide (PubChem CID 5056828) has the molecular formula C11H12N2O3S and a molecular weight of 252.29 g/mol. Its IUPAC name is N-(2-hydroxyethyl)quinoline-8-sulfonamide.

Molecular Properties

Compound NameN-(2-hydroxyethyl)quinoline-8-sulfonamide
PubChem CID5056828
Molecular FormulaC11H12N2O3S
Molecular Weight252.29 g/mol
Exact Mass252.06
IUPAC NameN-(2-hydroxyethyl)quinoline-8-sulfonamide
SMILESO=S(=O)(NCCO)c1cccc2cccnc12
InChIInChI=1S/C11H12N2O3S/c14-8-7-13-17(15,16)10-5-1-3-9-4-2-6-12-11(9)10/h1-6,13-14H,7-8H2
InChIKeyDQTXAXKQLOODEX-UHFFFAOYSA-N
XLogP0.51
TPSA79.29 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.29
LogP ≤ 50.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

8-Quinolinesulfonamide
CID 94464
4-(3-Quinolinyl)-Benzenesulfonamide
CID 122707123
2-Amino-N-quinolin-8-yl-benzenesulfonamide
CID 1070159
8-Quinolinesulfonyl chloride
CID 29220
8-Quinolinesulfonic acid
CID 66561
N-(4-isopropylphenyl)quinoline-8-sulfonamide
CID 4093866
8-Ethylsulfanylsulfonylquinoline
CID 913181
8-Methylsulfanylsulfonylquinoline
CID 913226
8-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)quinoline
CID 2870276
N-allyl-N-phenylquinoline-8-sulfonamide
CID 6621373
N-(4-chlorobenzyl)quinoline-8-sulfonamide
CID 16195529
8-Prop-2-enylsulfonylquinoline
CID 581982

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxyethyl)quinoline-8-sulfonamide?
The IUPAC name of N-(2-hydroxyethyl)quinoline-8-sulfonamide (CID 5056828) is N-(2-hydroxyethyl)quinoline-8-sulfonamide.
What is the SMILES notation for N-(2-hydroxyethyl)quinoline-8-sulfonamide?
The canonical SMILES for N-(2-hydroxyethyl)quinoline-8-sulfonamide is O=S(=O)(NCCO)c1cccc2cccnc12.
What is the InChIKey of N-(2-hydroxyethyl)quinoline-8-sulfonamide?
The InChIKey is DQTXAXKQLOODEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2O3S/c14-8-7-13-17(15,16)10-5-1-3-9-4-2-6-12-11(9)10/h1-6,13-14H,7-8H2.
What are the key properties of N-(2-hydroxyethyl)quinoline-8-sulfonamide?
N-(2-hydroxyethyl)quinoline-8-sulfonamide has a molecular weight of 252.29 g/mol, XLogP of 0.51, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxyethyl)quinoline-8-sulfonamide is sourced from PubChem (CID 5056828), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).