N-[2-(6-methoxy-2-oxo-1H-quinolin-3-yl)ethyl]propane-1-sulfonamide

C15H20N2O4S — CID 110326068

IUPACN-[2-(6-methoxy-2-oxo-1H-quinolin-3-yl)ethyl]propane-1-sulfonamide
SMILESCCCS(=O)(=O)NCCc1cc2cc(OC)ccc2[nH]c1=O
InChIInChI=1S/C15H20N2O4S/c1-3-8-22(19,20)16-7-6-11-9-12-10-13(21-2)4-5-14(12)17-15(11)18/h4-5,9-10,16H,3,6-8H2,1-2H3,(H,17,18)
InChIKeyBMSMHZPTISJHCG-UHFFFAOYSA-N
MW324.40 g/mol
LogP1.41
Rot. Bonds7

About N-[2-(6-methoxy-2-oxo-1H-quinolin-3-yl)ethyl]propane-1-sulfonamide

N-[2-(6-methoxy-2-oxo-1H-quinolin-3-yl)ethyl]propane-1-sulfonamide (PubChem CID 110326068) has the molecular formula C15H20N2O4S and a molecular weight of 324.40 g/mol. Its IUPAC name is N-[2-(6-methoxy-2-oxo-1H-quinolin-3-yl)ethyl]propane-1-sulfonamide.

Molecular Properties

Compound NameN-[2-(6-methoxy-2-oxo-1H-quinolin-3-yl)ethyl]propane-1-sulfonamide
PubChem CID110326068
Molecular FormulaC15H20N2O4S
Molecular Weight324.40 g/mol
Exact Mass324.11
IUPAC NameN-[2-(6-methoxy-2-oxo-1H-quinolin-3-yl)ethyl]propane-1-sulfonamide
SMILESCCCS(=O)(=O)NCCc1cc2cc(OC)ccc2[nH]c1=O
InChIInChI=1S/C15H20N2O4S/c1-3-8-22(19,20)16-7-6-11-9-12-10-13(21-2)4-5-14(12)17-15(11)18/h4-5,9-10,16H,3,6-8H2,1-2H3,(H,17,18)
InChIKeyBMSMHZPTISJHCG-UHFFFAOYSA-N
XLogP1.41
TPSA88.26 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.40
LogP ≤ 51.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(6-methoxy-2-oxo-1H-quinolin-3-yl)ethyl]-4-methylbenzenesulfonamide
CID 110326072
5-ethyl-N-[2-(6-methoxy-2-oxo-1H-quinolin-3-yl)ethyl]thiophene-2-sulfonamide
CID 110326084
4-methoxy-N-[2-(2-oxo-1H-quinolin-3-yl)ethyl]benzenesulfonamide
CID 110325662
N-[2-(2-chloro-4-methoxyphenyl)ethyl]propane-1-sulfonamide
CID 110789776
1-(2-chlorophenyl)-N-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]methanesulfonamide
CID 110324969
3-(hydroxymethyl)-6-methoxy-1H-quinolin-2-one
CID 865120
N-[2-(6-methoxy-2-oxo-1H-quinolin-3-yl)ethyl]benzamide
CID 110326009
N-[2-(6-methoxy-2-oxo-1H-quinolin-3-yl)ethyl]-4-methylbenzamide
CID 110326012
4-methoxy-N-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-2-methylbenzenesulfonamide
CID 110324955
N,N-diethyl-3-(6-methoxy-2-oxo-1H-quinolin-3-yl)propanamide
CID 53174783
5-ethyl-N-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]thiophene-2-sulfonamide
CID 110324960
N-[2-(2-oxo-1H-quinolin-3-yl)ethyl]-2-phenylethanesulfonamide
CID 110325696

Frequently Asked Questions

What is the IUPAC name of N-[2-(6-methoxy-2-oxo-1H-quinolin-3-yl)ethyl]propane-1-sulfonamide?
The IUPAC name of N-[2-(6-methoxy-2-oxo-1H-quinolin-3-yl)ethyl]propane-1-sulfonamide (CID 110326068) is N-[2-(6-methoxy-2-oxo-1H-quinolin-3-yl)ethyl]propane-1-sulfonamide.
What is the SMILES notation for N-[2-(6-methoxy-2-oxo-1H-quinolin-3-yl)ethyl]propane-1-sulfonamide?
The canonical SMILES for N-[2-(6-methoxy-2-oxo-1H-quinolin-3-yl)ethyl]propane-1-sulfonamide is CCCS(=O)(=O)NCCc1cc2cc(OC)ccc2[nH]c1=O.
What is the InChIKey of N-[2-(6-methoxy-2-oxo-1H-quinolin-3-yl)ethyl]propane-1-sulfonamide?
The InChIKey is BMSMHZPTISJHCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O4S/c1-3-8-22(19,20)16-7-6-11-9-12-10-13(21-2)4-5-14(12)17-15(11)18/h4-5,9-10,16H,3,6-8H2,1-2H3,(H,17,18).
What are the key properties of N-[2-(6-methoxy-2-oxo-1H-quinolin-3-yl)ethyl]propane-1-sulfonamide?
N-[2-(6-methoxy-2-oxo-1H-quinolin-3-yl)ethyl]propane-1-sulfonamide has a molecular weight of 324.40 g/mol, XLogP of 1.41, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(6-methoxy-2-oxo-1H-quinolin-3-yl)ethyl]propane-1-sulfonamide is sourced from PubChem (CID 110326068), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).