CID 154389818

C16H37OSn2 — CID 154389818

IUPAC
SMILESCCCC[SnH]O[Sn](CCCC)(CCCC)CCCC
InChIInChI=1S/4C4H9.O.2Sn.H/c4*1-3-4-2;;;;/h4*1,3-4H2,2H3;;;;
InChIKeyNUDZPSHMUJHFPJ-UHFFFAOYSA-N
MW482.89 g/mol
LogP5.92
Rot. Bonds14

About CID 154389818

CID 154389818 (PubChem CID 154389818) has the molecular formula C16H37OSn2 and a molecular weight of 482.89 g/mol.

Molecular Properties

Compound NameCID 154389818
PubChem CID154389818
Molecular FormulaC16H37OSn2
Molecular Weight482.89 g/mol
Exact Mass485.09
IUPAC Name
SMILESCCCC[SnH]O[Sn](CCCC)(CCCC)CCCC
InChIInChI=1S/4C4H9.O.2Sn.H/c4*1-3-4-2;;;;/h4*1,3-4H2,2H3;;;;
InChIKeyNUDZPSHMUJHFPJ-UHFFFAOYSA-N
XLogP5.92
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds14
Heavy Atoms19
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500482.89
LogP ≤ 55.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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 CID 154389818?
The IUPAC name of CID 154389818 (CID 154389818) is not available.
What is the SMILES notation for CID 154389818?
The canonical SMILES for CID 154389818 is CCCC[SnH]O[Sn](CCCC)(CCCC)CCCC.
What is the InChIKey of CID 154389818?
The InChIKey is NUDZPSHMUJHFPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/4C4H9.O.2Sn.H/c4*1-3-4-2;;;;/h4*1,3-4H2,2H3;;;;.
What are the key properties of CID 154389818?
CID 154389818 has a molecular weight of 482.89 g/mol, XLogP of 5.92, 14 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 154389818 is sourced from PubChem (CID 154389818), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).