CID 69433171

C18H23FN2O3Si2 — CID 69433171

IUPAC—
SMILESC[Si]OC(O[Si]C)C(C)(C)CC1CCC(=O)N1c1cc(F)ccc1C#N
InChIInChI=1S/C18H23FN2O3Si2/c1-18(2,17(23-25-3)24-26-4)10-14-7-8-16(22)21(14)15-9-13(19)6-5-12(15)11-20/h5-6,9,14,17H,7-8,10H2,1-4H3
InChIKeyRAWGWPBGSYRUDP-UHFFFAOYSA-N
MW390.56 g/mol
LogP3.30
Rot. Bonds8

About CID 69433171

CID 69433171 (PubChem CID 69433171) has the molecular formula C18H23FN2O3Si2 and a molecular weight of 390.56 g/mol.

Molecular Properties

Compound NameCID 69433171
PubChem CID69433171
Molecular FormulaC18H23FN2O3Si2
Molecular Weight390.56 g/mol
Exact Mass390.12
IUPAC Name—
SMILESC[Si]OC(O[Si]C)C(C)(C)CC1CCC(=O)N1c1cc(F)ccc1C#N
InChIInChI=1S/C18H23FN2O3Si2/c1-18(2,17(23-25-3)24-26-4)10-14-7-8-16(22)21(14)15-9-13(19)6-5-12(15)11-20/h5-6,9,14,17H,7-8,10H2,1-4H3
InChIKeyRAWGWPBGSYRUDP-UHFFFAOYSA-N
XLogP3.30
TPSA62.56 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.56
LogP ≤ 53.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'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 69433171?
The IUPAC name of CID 69433171 (CID 69433171) is not available.
What is the SMILES notation for CID 69433171?
The canonical SMILES for CID 69433171 is C[Si]OC(O[Si]C)C(C)(C)CC1CCC(=O)N1c1cc(F)ccc1C#N.
What is the InChIKey of CID 69433171?
The InChIKey is RAWGWPBGSYRUDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23FN2O3Si2/c1-18(2,17(23-25-3)24-26-4)10-14-7-8-16(22)21(14)15-9-13(19)6-5-12(15)11-20/h5-6,9,14,17H,7-8,10H2,1-4H3.
What are the key properties of CID 69433171?
CID 69433171 has a molecular weight of 390.56 g/mol, XLogP of 3.30, 8 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for CID 69433171 is sourced from PubChem (CID 69433171), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).