N-[3-[2-(ethylamino)ethoxy]propylsulfonyl]-2-methylpropanamide;molecular hydrogen

C11H28N2O4S — CID 155707478

IUPACN-[3-[2-(ethylamino)ethoxy]propylsulfonyl]-2-methylpropanamide;molecular hydrogen
SMILESCCNCCOCCCS(=O)(=O)NC(=O)C(C)C.[H][H].[H][H]
InChIInChI=1S/C11H24N2O4S.2H2/c1-4-12-6-8-17-7-5-9-18(15,16)13-11(14)10(2)3;;/h10,12H,4-9H2,1-3H3,(H,13,14);2*1H
InChIKeySOKOVIUZZOXMEB-UHFFFAOYSA-N
MW284.42 g/mol
LogP0.60
Rot. Bonds10

About N-[3-[2-(ethylamino)ethoxy]propylsulfonyl]-2-methylpropanamide;molecular hydrogen

N-[3-[2-(ethylamino)ethoxy]propylsulfonyl]-2-methylpropanamide;molecular hydrogen (PubChem CID 155707478) has the molecular formula C11H28N2O4S and a molecular weight of 284.42 g/mol. Its IUPAC name is N-[3-[2-(ethylamino)ethoxy]propylsulfonyl]-2-methylpropanamide;molecular hydrogen.

Molecular Properties

Compound NameN-[3-[2-(ethylamino)ethoxy]propylsulfonyl]-2-methylpropanamide;molecular hydrogen
PubChem CID155707478
Molecular FormulaC11H28N2O4S
Molecular Weight284.42 g/mol
Exact Mass284.18
IUPAC NameN-[3-[2-(ethylamino)ethoxy]propylsulfonyl]-2-methylpropanamide;molecular hydrogen
SMILESCCNCCOCCCS(=O)(=O)NC(=O)C(C)C.[H][H].[H][H]
InChIInChI=1S/C11H24N2O4S.2H2/c1-4-12-6-8-17-7-5-9-18(15,16)13-11(14)10(2)3;;/h10,12H,4-9H2,1-3H3,(H,13,14);2*1H
InChIKeySOKOVIUZZOXMEB-UHFFFAOYSA-N
XLogP0.60
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.42
LogP ≤ 50.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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-[3-[2-(ethylamino)ethoxy]propylsulfonyl]-2-methylpropanamide;molecular hydrogen?
The IUPAC name of N-[3-[2-(ethylamino)ethoxy]propylsulfonyl]-2-methylpropanamide;molecular hydrogen (CID 155707478) is N-[3-[2-(ethylamino)ethoxy]propylsulfonyl]-2-methylpropanamide;molecular hydrogen.
What is the SMILES notation for N-[3-[2-(ethylamino)ethoxy]propylsulfonyl]-2-methylpropanamide;molecular hydrogen?
The canonical SMILES for N-[3-[2-(ethylamino)ethoxy]propylsulfonyl]-2-methylpropanamide;molecular hydrogen is CCNCCOCCCS(=O)(=O)NC(=O)C(C)C.[H][H].[H][H].
What is the InChIKey of N-[3-[2-(ethylamino)ethoxy]propylsulfonyl]-2-methylpropanamide;molecular hydrogen?
The InChIKey is SOKOVIUZZOXMEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O4S.2H2/c1-4-12-6-8-17-7-5-9-18(15,16)13-11(14)10(2)3;;/h10,12H,4-9H2,1-3H3,(H,13,14);2*1H.
What are the key properties of N-[3-[2-(ethylamino)ethoxy]propylsulfonyl]-2-methylpropanamide;molecular hydrogen?
N-[3-[2-(ethylamino)ethoxy]propylsulfonyl]-2-methylpropanamide;molecular hydrogen has a molecular weight of 284.42 g/mol, XLogP of 0.60, 10 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[2-(ethylamino)ethoxy]propylsulfonyl]-2-methylpropanamide;molecular hydrogen is sourced from PubChem (CID 155707478), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).