CID 19392003

C13H19OSi — CID 19392003

IUPAC
SMILESCCCC(CCC)(O[Si])c1ccccc1
InChIInChI=1S/C13H19OSi/c1-3-10-13(14-15,11-4-2)12-8-6-5-7-9-12/h5-9H,3-4,10-11H2,1-2H3
InChIKeyHCMXYTIYBMRABV-UHFFFAOYSA-N
MW219.38 g/mol
LogP3.58
Rot. Bonds6

About CID 19392003

CID 19392003 (PubChem CID 19392003) has the molecular formula C13H19OSi and a molecular weight of 219.38 g/mol.

Molecular Properties

Compound NameCID 19392003
PubChem CID19392003
Molecular FormulaC13H19OSi
Molecular Weight219.38 g/mol
Exact Mass219.12
IUPAC Name
SMILESCCCC(CCC)(O[Si])c1ccccc1
InChIInChI=1S/C13H19OSi/c1-3-10-13(14-15,11-4-2)12-8-6-5-7-9-12/h5-9H,3-4,10-11H2,1-2H3
InChIKeyHCMXYTIYBMRABV-UHFFFAOYSA-N
XLogP3.58
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.38
LogP ≤ 53.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of CID 19392003?
The IUPAC name of CID 19392003 (CID 19392003) is not available.
What is the SMILES notation for CID 19392003?
The canonical SMILES for CID 19392003 is CCCC(CCC)(O[Si])c1ccccc1.
What is the InChIKey of CID 19392003?
The InChIKey is HCMXYTIYBMRABV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19OSi/c1-3-10-13(14-15,11-4-2)12-8-6-5-7-9-12/h5-9H,3-4,10-11H2,1-2H3.
What are the key properties of CID 19392003?
CID 19392003 has a molecular weight of 219.38 g/mol, XLogP of 3.58, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 19392003 is sourced from PubChem (CID 19392003), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).