1-[ethyl(sulfino)amino]propane;rutherfordium

C5H13NO2RfS — CID 59155384

IUPAC1-[ethyl(sulfino)amino]propane;rutherfordium
SMILESCCCN(CC)S(=O)O.[Rf]
InChIInChI=1S/C5H13NO2S.Rf/c1-3-5-6(4-2)9(7)8;/h3-5H2,1-2H3,(H,7,8);
InChIKeyNCPFWJPNHQBFGO-UHFFFAOYSA-N
MW418.23 g/mol
LogP0.86
Rot. Bonds4

About 1-[ethyl(sulfino)amino]propane;rutherfordium

1-[ethyl(sulfino)amino]propane;rutherfordium (PubChem CID 59155384) has the molecular formula C5H13NO2RfS and a molecular weight of 418.23 g/mol. Its IUPAC name is 1-[ethyl(sulfino)amino]propane;rutherfordium.

Molecular Properties

Compound Name1-[ethyl(sulfino)amino]propane;rutherfordium
PubChem CID59155384
Molecular FormulaC5H13NO2RfS
Molecular Weight418.23 g/mol
Exact Mass418.19
IUPAC Name1-[ethyl(sulfino)amino]propane;rutherfordium
SMILESCCCN(CC)S(=O)O.[Rf]
InChIInChI=1S/C5H13NO2S.Rf/c1-3-5-6(4-2)9(7)8;/h3-5H2,1-2H3,(H,7,8);
InChIKeyNCPFWJPNHQBFGO-UHFFFAOYSA-N
XLogP0.86
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500418.23
LogP ≤ 50.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-[ethyl(sulfino)amino]propane;rutherfordium?
The IUPAC name of 1-[ethyl(sulfino)amino]propane;rutherfordium (CID 59155384) is 1-[ethyl(sulfino)amino]propane;rutherfordium.
What is the SMILES notation for 1-[ethyl(sulfino)amino]propane;rutherfordium?
The canonical SMILES for 1-[ethyl(sulfino)amino]propane;rutherfordium is CCCN(CC)S(=O)O.[Rf].
What is the InChIKey of 1-[ethyl(sulfino)amino]propane;rutherfordium?
The InChIKey is NCPFWJPNHQBFGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H13NO2S.Rf/c1-3-5-6(4-2)9(7)8;/h3-5H2,1-2H3,(H,7,8);.
What are the key properties of 1-[ethyl(sulfino)amino]propane;rutherfordium?
1-[ethyl(sulfino)amino]propane;rutherfordium has a molecular weight of 418.23 g/mol, XLogP of 0.86, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[ethyl(sulfino)amino]propane;rutherfordium is sourced from PubChem (CID 59155384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).