N-[6-(2-methoxyethoxy)-3-pyridinyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-2-sulfonamide

C15H20N4O4S — CID 86771315

IUPACN-[6-(2-methoxyethoxy)-3-pyridinyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-2-sulfonamide
SMILESCOCCOc1ccc(NS(=O)(=O)c2cn3c(n2)CCCC3)cn1
InChIInChI=1S/C15H20N4O4S/c1-22-8-9-23-14-6-5-12(10-16-14)18-24(20,21)15-11-19-7-3-2-4-13(19)17-15/h5-6,10-11,18H,2-4,7-9H2,1H3
InChIKeyAEBVGBLZQBFRKD-UHFFFAOYSA-N
MW352.42 g/mol
LogP1.44
Rot. Bonds7

About N-[6-(2-methoxyethoxy)-3-pyridinyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-2-sulfonamide

N-[6-(2-methoxyethoxy)-3-pyridinyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-2-sulfonamide (PubChem CID 86771315) has the molecular formula C15H20N4O4S and a molecular weight of 352.42 g/mol. Its IUPAC name is N-[6-(2-methoxyethoxy)-3-pyridinyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-2-sulfonamide.

Molecular Properties

Compound NameN-[6-(2-methoxyethoxy)-3-pyridinyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-2-sulfonamide
PubChem CID86771315
Molecular FormulaC15H20N4O4S
Molecular Weight352.42 g/mol
Exact Mass352.12
IUPAC NameN-[6-(2-methoxyethoxy)-3-pyridinyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-2-sulfonamide
SMILESCOCCOc1ccc(NS(=O)(=O)c2cn3c(n2)CCCC3)cn1
InChIInChI=1S/C15H20N4O4S/c1-22-8-9-23-14-6-5-12(10-16-14)18-24(20,21)15-11-19-7-3-2-4-13(19)17-15/h5-6,10-11,18H,2-4,7-9H2,1H3
InChIKeyAEBVGBLZQBFRKD-UHFFFAOYSA-N
XLogP1.44
TPSA95.34 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.42
LogP ≤ 51.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-[6-(2-methoxyethoxy)-3-pyridinyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-2-sulfonamide?
The IUPAC name of N-[6-(2-methoxyethoxy)-3-pyridinyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-2-sulfonamide (CID 86771315) is N-[6-(2-methoxyethoxy)-3-pyridinyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-2-sulfonamide.
What is the SMILES notation for N-[6-(2-methoxyethoxy)-3-pyridinyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-2-sulfonamide?
The canonical SMILES for N-[6-(2-methoxyethoxy)-3-pyridinyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-2-sulfonamide is COCCOc1ccc(NS(=O)(=O)c2cn3c(n2)CCCC3)cn1.
What is the InChIKey of N-[6-(2-methoxyethoxy)-3-pyridinyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-2-sulfonamide?
The InChIKey is AEBVGBLZQBFRKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O4S/c1-22-8-9-23-14-6-5-12(10-16-14)18-24(20,21)15-11-19-7-3-2-4-13(19)17-15/h5-6,10-11,18H,2-4,7-9H2,1H3.
What are the key properties of N-[6-(2-methoxyethoxy)-3-pyridinyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-2-sulfonamide?
N-[6-(2-methoxyethoxy)-3-pyridinyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-2-sulfonamide has a molecular weight of 352.42 g/mol, XLogP of 1.44, 7 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(2-methoxyethoxy)-3-pyridinyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-2-sulfonamide is sourced from PubChem (CID 86771315), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).