N-(2,3-dihydro-1H-inden-1-yl)-6-oxo-1H-pyridine-3-sulfonamide

C14H14N2O3S — CID 61274764

IUPACN-(2,3-dihydro-1H-inden-1-yl)-6-oxo-1H-pyridine-3-sulfonamide
SMILESO=c1ccc(S(=O)(=O)NC2CCc3ccccc32)c[nH]1
InChIInChI=1S/C14H14N2O3S/c17-14-8-6-11(9-15-14)20(18,19)16-13-7-5-10-3-1-2-4-12(10)13/h1-4,6,8-9,13,16H,5,7H2,(H,15,17)
InChIKeyABZOZIQMBFBQJK-UHFFFAOYSA-N
MW290.34 g/mol
LogP1.34
Rot. Bonds3

About N-(2,3-dihydro-1H-inden-1-yl)-6-oxo-1H-pyridine-3-sulfonamide

N-(2,3-dihydro-1H-inden-1-yl)-6-oxo-1H-pyridine-3-sulfonamide (PubChem CID 61274764) has the molecular formula C14H14N2O3S and a molecular weight of 290.34 g/mol. Its IUPAC name is N-(2,3-dihydro-1H-inden-1-yl)-6-oxo-1H-pyridine-3-sulfonamide.

Molecular Properties

Compound NameN-(2,3-dihydro-1H-inden-1-yl)-6-oxo-1H-pyridine-3-sulfonamide
PubChem CID61274764
Molecular FormulaC14H14N2O3S
Molecular Weight290.34 g/mol
Exact Mass290.07
IUPAC NameN-(2,3-dihydro-1H-inden-1-yl)-6-oxo-1H-pyridine-3-sulfonamide
SMILESO=c1ccc(S(=O)(=O)NC2CCc3ccccc32)c[nH]1
InChIInChI=1S/C14H14N2O3S/c17-14-8-6-11(9-15-14)20(18,19)16-13-7-5-10-3-1-2-4-12(10)13/h1-4,6,8-9,13,16H,5,7H2,(H,15,17)
InChIKeyABZOZIQMBFBQJK-UHFFFAOYSA-N
XLogP1.34
TPSA79.03 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.34
LogP ≤ 51.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2,3-dihydro-1H-inden-1-yl)-6-oxo-1H-pyridine-3-sulfonamide?
The IUPAC name of N-(2,3-dihydro-1H-inden-1-yl)-6-oxo-1H-pyridine-3-sulfonamide (CID 61274764) is N-(2,3-dihydro-1H-inden-1-yl)-6-oxo-1H-pyridine-3-sulfonamide.
What is the SMILES notation for N-(2,3-dihydro-1H-inden-1-yl)-6-oxo-1H-pyridine-3-sulfonamide?
The canonical SMILES for N-(2,3-dihydro-1H-inden-1-yl)-6-oxo-1H-pyridine-3-sulfonamide is O=c1ccc(S(=O)(=O)NC2CCc3ccccc32)c[nH]1.
What is the InChIKey of N-(2,3-dihydro-1H-inden-1-yl)-6-oxo-1H-pyridine-3-sulfonamide?
The InChIKey is ABZOZIQMBFBQJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2O3S/c17-14-8-6-11(9-15-14)20(18,19)16-13-7-5-10-3-1-2-4-12(10)13/h1-4,6,8-9,13,16H,5,7H2,(H,15,17).
What are the key properties of N-(2,3-dihydro-1H-inden-1-yl)-6-oxo-1H-pyridine-3-sulfonamide?
N-(2,3-dihydro-1H-inden-1-yl)-6-oxo-1H-pyridine-3-sulfonamide has a molecular weight of 290.34 g/mol, XLogP of 1.34, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dihydro-1H-inden-1-yl)-6-oxo-1H-pyridine-3-sulfonamide is sourced from PubChem (CID 61274764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).