N-(2-oxo-5,6,7,8-tetrahydro-1H-quinolin-6-yl)cyclopropanesulfonamide

C12H16N2O3S — CID 118740763

IUPACN-(2-oxo-5,6,7,8-tetrahydro-1H-quinolin-6-yl)cyclopropanesulfonamide
SMILESO=c1ccc2c([nH]1)CCC(NS(=O)(=O)C1CC1)C2
InChIInChI=1S/C12H16N2O3S/c15-12-6-1-8-7-9(2-5-11(8)13-12)14-18(16,17)10-3-4-10/h1,6,9-10,14H,2-5,7H2,(H,13,15)
InChIKeySYDIVZKSVHKIBU-UHFFFAOYSA-N
MW268.34 g/mol
LogP0.31
Rot. Bonds3

About N-(2-oxo-5,6,7,8-tetrahydro-1H-quinolin-6-yl)cyclopropanesulfonamide

N-(2-oxo-5,6,7,8-tetrahydro-1H-quinolin-6-yl)cyclopropanesulfonamide (PubChem CID 118740763) has the molecular formula C12H16N2O3S and a molecular weight of 268.34 g/mol. Its IUPAC name is N-(2-oxo-5,6,7,8-tetrahydro-1H-quinolin-6-yl)cyclopropanesulfonamide.

Molecular Properties

Compound NameN-(2-oxo-5,6,7,8-tetrahydro-1H-quinolin-6-yl)cyclopropanesulfonamide
PubChem CID118740763
Molecular FormulaC12H16N2O3S
Molecular Weight268.34 g/mol
Exact Mass268.09
IUPAC NameN-(2-oxo-5,6,7,8-tetrahydro-1H-quinolin-6-yl)cyclopropanesulfonamide
SMILESO=c1ccc2c([nH]1)CCC(NS(=O)(=O)C1CC1)C2
InChIInChI=1S/C12H16N2O3S/c15-12-6-1-8-7-9(2-5-11(8)13-12)14-18(16,17)10-3-4-10/h1,6,9-10,14H,2-5,7H2,(H,13,15)
InChIKeySYDIVZKSVHKIBU-UHFFFAOYSA-N
XLogP0.31
TPSA79.03 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.34
LogP ≤ 50.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-oxo-5,6,7,8-tetrahydro-1H-quinolin-6-yl)cyclopropanesulfonamide?
The IUPAC name of N-(2-oxo-5,6,7,8-tetrahydro-1H-quinolin-6-yl)cyclopropanesulfonamide (CID 118740763) is N-(2-oxo-5,6,7,8-tetrahydro-1H-quinolin-6-yl)cyclopropanesulfonamide.
What is the SMILES notation for N-(2-oxo-5,6,7,8-tetrahydro-1H-quinolin-6-yl)cyclopropanesulfonamide?
The canonical SMILES for N-(2-oxo-5,6,7,8-tetrahydro-1H-quinolin-6-yl)cyclopropanesulfonamide is O=c1ccc2c([nH]1)CCC(NS(=O)(=O)C1CC1)C2.
What is the InChIKey of N-(2-oxo-5,6,7,8-tetrahydro-1H-quinolin-6-yl)cyclopropanesulfonamide?
The InChIKey is SYDIVZKSVHKIBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2O3S/c15-12-6-1-8-7-9(2-5-11(8)13-12)14-18(16,17)10-3-4-10/h1,6,9-10,14H,2-5,7H2,(H,13,15).
What are the key properties of N-(2-oxo-5,6,7,8-tetrahydro-1H-quinolin-6-yl)cyclopropanesulfonamide?
N-(2-oxo-5,6,7,8-tetrahydro-1H-quinolin-6-yl)cyclopropanesulfonamide has a molecular weight of 268.34 g/mol, XLogP of 0.31, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-oxo-5,6,7,8-tetrahydro-1H-quinolin-6-yl)cyclopropanesulfonamide is sourced from PubChem (CID 118740763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).