N-[6-(2-methoxyethoxy)-3-pyridinyl]propane-1-sulfonamide

C11H18N2O4S — CID 64591758

IUPACN-[6-(2-methoxyethoxy)-3-pyridinyl]propane-1-sulfonamide
SMILESCCCS(=O)(=O)Nc1ccc(OCCOC)nc1
InChIInChI=1S/C11H18N2O4S/c1-3-8-18(14,15)13-10-4-5-11(12-9-10)17-7-6-16-2/h4-5,9,13H,3,6-8H2,1-2H3
InChIKeyHENQRFUZGBESHK-UHFFFAOYSA-N
MW274.34 g/mol
LogP1.26
Rot. Bonds8

About N-[6-(2-methoxyethoxy)-3-pyridinyl]propane-1-sulfonamide

N-[6-(2-methoxyethoxy)-3-pyridinyl]propane-1-sulfonamide (PubChem CID 64591758) has the molecular formula C11H18N2O4S and a molecular weight of 274.34 g/mol. Its IUPAC name is N-[6-(2-methoxyethoxy)-3-pyridinyl]propane-1-sulfonamide.

Molecular Properties

Compound NameN-[6-(2-methoxyethoxy)-3-pyridinyl]propane-1-sulfonamide
PubChem CID64591758
Molecular FormulaC11H18N2O4S
Molecular Weight274.34 g/mol
Exact Mass274.10
IUPAC NameN-[6-(2-methoxyethoxy)-3-pyridinyl]propane-1-sulfonamide
SMILESCCCS(=O)(=O)Nc1ccc(OCCOC)nc1
InChIInChI=1S/C11H18N2O4S/c1-3-8-18(14,15)13-10-4-5-11(12-9-10)17-7-6-16-2/h4-5,9,13H,3,6-8H2,1-2H3
InChIKeyHENQRFUZGBESHK-UHFFFAOYSA-N
XLogP1.26
TPSA77.52 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.34
LogP ≤ 51.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

4-chloro-N-[6-(2-methoxyethoxy)-3-pyridinyl]butane-1-sulfonamide
CID 116815594
N-[6-(2-methoxyethoxy)-3-pyridinyl]piperazine-1-sulfonamide
CID 61254488
N-(3,3-dimethylbutyl)-6-(2-methoxyethoxy)pyridin-3-amine
CID 62950387
N-(6-ethoxy-3-pyridinyl)-4-(methylamino)butane-1-sulfonamide
CID 106072665
2-(4-fluorophenoxy)-N-(6-methoxy-3-pyridinyl)ethanesulfonamide
CID 110301907
6-(2-methoxyethoxy)-N-prop-2-ynylpyridin-3-amine
CID 63951273
4-(cyclopropylamino)-N-(6-ethoxy-3-pyridinyl)butane-1-sulfonamide
CID 106072696
N-[6-(2-methoxyethoxy)-3-pyridinyl]-2-(methylamino)acetamide
CID 43704151
2-bromo-N-[6-(2-methoxyethoxy)-3-pyridinyl]-2-methylpropanamide
CID 100773616
N-(6-ethoxy-3-pyridinyl)-4-(propan-2-ylamino)butane-1-sulfonamide
CID 106072666
6-(2-methoxyethoxy)-N-octan-2-ylpyridin-3-amine
CID 43688384
4-(cyclopropylamino)-N-(6-methoxy-3-pyridinyl)butane-1-sulfonamide
CID 106059988

Frequently Asked Questions

What is the IUPAC name of N-[6-(2-methoxyethoxy)-3-pyridinyl]propane-1-sulfonamide?
The IUPAC name of N-[6-(2-methoxyethoxy)-3-pyridinyl]propane-1-sulfonamide (CID 64591758) is N-[6-(2-methoxyethoxy)-3-pyridinyl]propane-1-sulfonamide.
What is the SMILES notation for N-[6-(2-methoxyethoxy)-3-pyridinyl]propane-1-sulfonamide?
The canonical SMILES for N-[6-(2-methoxyethoxy)-3-pyridinyl]propane-1-sulfonamide is CCCS(=O)(=O)Nc1ccc(OCCOC)nc1.
What is the InChIKey of N-[6-(2-methoxyethoxy)-3-pyridinyl]propane-1-sulfonamide?
The InChIKey is HENQRFUZGBESHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O4S/c1-3-8-18(14,15)13-10-4-5-11(12-9-10)17-7-6-16-2/h4-5,9,13H,3,6-8H2,1-2H3.
What are the key properties of N-[6-(2-methoxyethoxy)-3-pyridinyl]propane-1-sulfonamide?
N-[6-(2-methoxyethoxy)-3-pyridinyl]propane-1-sulfonamide has a molecular weight of 274.34 g/mol, XLogP of 1.26, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(2-methoxyethoxy)-3-pyridinyl]propane-1-sulfonamide is sourced from PubChem (CID 64591758), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).