N-methyl-N-[4-(quinolin-8-ylsulfonylamino)phenyl]acetamide

C18H17N3O3S — CID 22775261

IUPACN-methyl-N-[4-(quinolin-8-ylsulfonylamino)phenyl]acetamide
SMILESCC(=O)N(C)c1ccc(NS(=O)(=O)c2cccc3cccnc23)cc1
InChIInChI=1S/C18H17N3O3S/c1-13(22)21(2)16-10-8-15(9-11-16)20-25(23,24)17-7-3-5-14-6-4-12-19-18(14)17/h3-12,20H,1-2H3
InChIKeySTHBTXQQOMOCLR-UHFFFAOYSA-N
MW355.42 g/mol
LogP3.02
Rot. Bonds4

About N-methyl-N-[4-(quinolin-8-ylsulfonylamino)phenyl]acetamide

N-methyl-N-[4-(quinolin-8-ylsulfonylamino)phenyl]acetamide (PubChem CID 22775261) has the molecular formula C18H17N3O3S and a molecular weight of 355.42 g/mol. Its IUPAC name is N-methyl-N-[4-(quinolin-8-ylsulfonylamino)phenyl]acetamide.

Molecular Properties

Compound NameN-methyl-N-[4-(quinolin-8-ylsulfonylamino)phenyl]acetamide
PubChem CID22775261
Molecular FormulaC18H17N3O3S
Molecular Weight355.42 g/mol
Exact Mass355.10
IUPAC NameN-methyl-N-[4-(quinolin-8-ylsulfonylamino)phenyl]acetamide
SMILESCC(=O)N(C)c1ccc(NS(=O)(=O)c2cccc3cccnc23)cc1
InChIInChI=1S/C18H17N3O3S/c1-13(22)21(2)16-10-8-15(9-11-16)20-25(23,24)17-7-3-5-14-6-4-12-19-18(14)17/h3-12,20H,1-2H3
InChIKeySTHBTXQQOMOCLR-UHFFFAOYSA-N
XLogP3.02
TPSA79.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.42
LogP ≤ 53.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[4-(quinolin-8-ylsulfonylamino)phenyl]acetamide
CID 2443922
N-(4-bromophenyl)quinoline-8-sulfonamide
CID 3423367
N-[4-[(R)-methylsulfinyl]phenyl]quinoline-8-sulfonamide
CID 95781119
N-(4-formylphenyl)quinoline-8-sulfonamide
CID 121290762
[4-(quinolin-8-ylsulfonylamino)phenyl] propanoate
CID 59635021
(E)-N-hydroxy-3-[4-(quinolin-8-ylsulfonylamino)phenyl]prop-2-enamide
CID 11003161
N-[4-[4-[[4-(dimethylamino)phenyl]methyl]piperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide
CID 59635159
N-(2-hydroxyphenyl)-4-(quinolin-8-ylsulfonylamino)benzamide
CID 5045370
2-(diethylamino)ethyl 4-(quinolin-8-ylsulfonylamino)benzoate
CID 22204194
N-[4-(trifluoromethoxy)phenyl]quinoline-8-sulfonamide
CID 4259954
N-[4-(cyanomethyl)phenyl]quinoline-8-sulfonamide
CID 74225429
2-methoxy-4-(quinolin-8-ylsulfonylamino)benzoic acid
CID 118468092

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[4-(quinolin-8-ylsulfonylamino)phenyl]acetamide?
The IUPAC name of N-methyl-N-[4-(quinolin-8-ylsulfonylamino)phenyl]acetamide (CID 22775261) is N-methyl-N-[4-(quinolin-8-ylsulfonylamino)phenyl]acetamide.
What is the SMILES notation for N-methyl-N-[4-(quinolin-8-ylsulfonylamino)phenyl]acetamide?
The canonical SMILES for N-methyl-N-[4-(quinolin-8-ylsulfonylamino)phenyl]acetamide is CC(=O)N(C)c1ccc(NS(=O)(=O)c2cccc3cccnc23)cc1.
What is the InChIKey of N-methyl-N-[4-(quinolin-8-ylsulfonylamino)phenyl]acetamide?
The InChIKey is STHBTXQQOMOCLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17N3O3S/c1-13(22)21(2)16-10-8-15(9-11-16)20-25(23,24)17-7-3-5-14-6-4-12-19-18(14)17/h3-12,20H,1-2H3.
What are the key properties of N-methyl-N-[4-(quinolin-8-ylsulfonylamino)phenyl]acetamide?
N-methyl-N-[4-(quinolin-8-ylsulfonylamino)phenyl]acetamide has a molecular weight of 355.42 g/mol, XLogP of 3.02, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[4-(quinolin-8-ylsulfonylamino)phenyl]acetamide is sourced from PubChem (CID 22775261), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).