N-(4-methoxyphenyl)quinoline-8-sulfonamide

C16H14N2O3S — CID 644511

IUPACN-(4-methoxyphenyl)quinoline-8-sulfonamide
SMILESCOc1ccc(NS(=O)(=O)c2cccc3cccnc23)cc1
InChIInChI=1S/C16H14N2O3S/c1-21-14-9-7-13(8-10-14)18-22(19,20)15-6-2-4-12-5-3-11-17-16(12)15/h2-11,18H,1H3
InChIKeyPAAJKYWVOKEQED-UHFFFAOYSA-N
MW314.37 g/mol
LogP3.04
Rot. Bonds4

About N-(4-methoxyphenyl)quinoline-8-sulfonamide

N-(4-methoxyphenyl)quinoline-8-sulfonamide (PubChem CID 644511) has the molecular formula C16H14N2O3S and a molecular weight of 314.37 g/mol. Its IUPAC name is N-(4-methoxyphenyl)quinoline-8-sulfonamide.

Molecular Properties

Compound NameN-(4-methoxyphenyl)quinoline-8-sulfonamide
PubChem CID644511
Molecular FormulaC16H14N2O3S
Molecular Weight314.37 g/mol
Exact Mass314.07
IUPAC NameN-(4-methoxyphenyl)quinoline-8-sulfonamide
SMILESCOc1ccc(NS(=O)(=O)c2cccc3cccnc23)cc1
InChIInChI=1S/C16H14N2O3S/c1-21-14-9-7-13(8-10-14)18-22(19,20)15-6-2-4-12-5-3-11-17-16(12)15/h2-11,18H,1H3
InChIKeyPAAJKYWVOKEQED-UHFFFAOYSA-N
XLogP3.04
TPSA68.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.37
LogP ≤ 53.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(6-Methoxy-8-quinolinyl)-4-methylbenzenesulfonamide
CID 130606
5-methoxy-1-(phenylsulfonyl)-1H-indole
CID 6473679
2,5-dimethoxy-N-(quinolin-3-yl)benzenesulfonamide
CID 2931238
6-Methoxy-N-(3-sulfopropyl)quinolinium
CID 123936
Substituted phenylsulfonyltryptamine, 11i
CID 23655464
N-(4-methoxyphenyl)quinolin-4-amine
CID 739629
4-[3-(2-Diethylamino-ethyl)-5-methoxy-indole-1-sulfonyl]-phenylamine
CID 10250472
4-[5-Methoxy-3-(1,2,3,6-tetrahydro-pyridin-4-yl)-indole-1-sulfonyl]-phenylamine
CID 11361090
4-[3-(2-Dimethylamino-ethyl)-5-methoxy-indole-1-sulfonyl]-phenylamine
CID 23844114
2-(5-Methoxy-1-naphthalen-1-ylsulfonylindol-3-yl)ethanamine
CID 44398325
N-[4-(pentyloxy)phenyl]-2-(quinolin-8-ylsulfanyl)acetamide
CID 1964370
N-(4-hydroxyphenyl)-8-quinolinesulfonamide
CID 894115

Frequently Asked Questions

What is the IUPAC name of N-(4-methoxyphenyl)quinoline-8-sulfonamide?
The IUPAC name of N-(4-methoxyphenyl)quinoline-8-sulfonamide (CID 644511) is N-(4-methoxyphenyl)quinoline-8-sulfonamide.
What is the SMILES notation for N-(4-methoxyphenyl)quinoline-8-sulfonamide?
The canonical SMILES for N-(4-methoxyphenyl)quinoline-8-sulfonamide is COc1ccc(NS(=O)(=O)c2cccc3cccnc23)cc1.
What is the InChIKey of N-(4-methoxyphenyl)quinoline-8-sulfonamide?
The InChIKey is PAAJKYWVOKEQED-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N2O3S/c1-21-14-9-7-13(8-10-14)18-22(19,20)15-6-2-4-12-5-3-11-17-16(12)15/h2-11,18H,1H3.
What are the key properties of N-(4-methoxyphenyl)quinoline-8-sulfonamide?
N-(4-methoxyphenyl)quinoline-8-sulfonamide has a molecular weight of 314.37 g/mol, XLogP of 3.04, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxyphenyl)quinoline-8-sulfonamide is sourced from PubChem (CID 644511), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).