N-[2-(diethylamino)ethyl]-6-oxo-1H-pyridine-3-sulfonamide

C11H19N3O3S — CID 43629185

IUPACN-[2-(diethylamino)ethyl]-6-oxo-1H-pyridine-3-sulfonamide
SMILESCCN(CC)CCNS(=O)(=O)c1ccc(=O)[nH]c1
InChIInChI=1S/C11H19N3O3S/c1-3-14(4-2)8-7-13-18(16,17)10-5-6-11(15)12-9-10/h5-6,9,13H,3-4,7-8H2,1-2H3,(H,12,15)
InChIKeyLOHANJGTXZYWSN-UHFFFAOYSA-N
MW273.36 g/mol
LogP-0.00
Rot. Bonds7

About N-[2-(diethylamino)ethyl]-6-oxo-1H-pyridine-3-sulfonamide

N-[2-(diethylamino)ethyl]-6-oxo-1H-pyridine-3-sulfonamide (PubChem CID 43629185) has the molecular formula C11H19N3O3S and a molecular weight of 273.36 g/mol. Its IUPAC name is N-[2-(diethylamino)ethyl]-6-oxo-1H-pyridine-3-sulfonamide.

Molecular Properties

Compound NameN-[2-(diethylamino)ethyl]-6-oxo-1H-pyridine-3-sulfonamide
PubChem CID43629185
Molecular FormulaC11H19N3O3S
Molecular Weight273.36 g/mol
Exact Mass273.11
IUPAC NameN-[2-(diethylamino)ethyl]-6-oxo-1H-pyridine-3-sulfonamide
SMILESCCN(CC)CCNS(=O)(=O)c1ccc(=O)[nH]c1
InChIInChI=1S/C11H19N3O3S/c1-3-14(4-2)8-7-13-18(16,17)10-5-6-11(15)12-9-10/h5-6,9,13H,3-4,7-8H2,1-2H3,(H,12,15)
InChIKeyLOHANJGTXZYWSN-UHFFFAOYSA-N
XLogP-0.00
TPSA82.27 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.36
LogP ≤ 5-0.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[2-(diethylamino)ethyl]-6-oxo-1H-pyridine-3-sulfonamide?
The IUPAC name of N-[2-(diethylamino)ethyl]-6-oxo-1H-pyridine-3-sulfonamide (CID 43629185) is N-[2-(diethylamino)ethyl]-6-oxo-1H-pyridine-3-sulfonamide.
What is the SMILES notation for N-[2-(diethylamino)ethyl]-6-oxo-1H-pyridine-3-sulfonamide?
The canonical SMILES for N-[2-(diethylamino)ethyl]-6-oxo-1H-pyridine-3-sulfonamide is CCN(CC)CCNS(=O)(=O)c1ccc(=O)[nH]c1.
What is the InChIKey of N-[2-(diethylamino)ethyl]-6-oxo-1H-pyridine-3-sulfonamide?
The InChIKey is LOHANJGTXZYWSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O3S/c1-3-14(4-2)8-7-13-18(16,17)10-5-6-11(15)12-9-10/h5-6,9,13H,3-4,7-8H2,1-2H3,(H,12,15).
What are the key properties of N-[2-(diethylamino)ethyl]-6-oxo-1H-pyridine-3-sulfonamide?
N-[2-(diethylamino)ethyl]-6-oxo-1H-pyridine-3-sulfonamide has a molecular weight of 273.36 g/mol, XLogP of -0.00, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(diethylamino)ethyl]-6-oxo-1H-pyridine-3-sulfonamide is sourced from PubChem (CID 43629185), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).