CID 162696886

C19H40N2O3Si — CID 162696886

IUPAC—
SMILESCCOC(OCC)[Si]CCCNC1CC(C)(C)N(OCC)C(C)(C)C1
InChIInChI=1S/C19H40N2O3Si/c1-8-22-17(23-9-2)25-13-11-12-20-16-14-18(4,5)21(24-10-3)19(6,7)15-16/h16-17,20H,8-15H2,1-7H3
InChIKeyJQIVVPJPQLRWMU-UHFFFAOYSA-N
MW372.63 g/mol
LogP3.42
Rot. Bonds12

About CID 162696886

CID 162696886 (PubChem CID 162696886) has the molecular formula C19H40N2O3Si and a molecular weight of 372.63 g/mol.

Molecular Properties

Compound NameCID 162696886
PubChem CID162696886
Molecular FormulaC19H40N2O3Si
Molecular Weight372.63 g/mol
Exact Mass372.28
IUPAC Name—
SMILESCCOC(OCC)[Si]CCCNC1CC(C)(C)N(OCC)C(C)(C)C1
InChIInChI=1S/C19H40N2O3Si/c1-8-22-17(23-9-2)25-13-11-12-20-16-14-18(4,5)21(24-10-3)19(6,7)15-16/h16-17,20H,8-15H2,1-7H3
InChIKeyJQIVVPJPQLRWMU-UHFFFAOYSA-N
XLogP3.42
TPSA42.96 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds12
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.63
LogP ≤ 53.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of CID 162696886?
The IUPAC name of CID 162696886 (CID 162696886) is not available.
What is the SMILES notation for CID 162696886?
The canonical SMILES for CID 162696886 is CCOC(OCC)[Si]CCCNC1CC(C)(C)N(OCC)C(C)(C)C1.
What is the InChIKey of CID 162696886?
The InChIKey is JQIVVPJPQLRWMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H40N2O3Si/c1-8-22-17(23-9-2)25-13-11-12-20-16-14-18(4,5)21(24-10-3)19(6,7)15-16/h16-17,20H,8-15H2,1-7H3.
What are the key properties of CID 162696886?
CID 162696886 has a molecular weight of 372.63 g/mol, XLogP of 3.42, 12 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for CID 162696886 is sourced from PubChem (CID 162696886), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).