CID 172619330

C20H48N2O2Si4 — CID 172619330

IUPAC
SMILESCCN(CC)C([Si]CC[Si](C)(C)O[Si](C)(C)C(C)[Si]OC(C)C)N(CC)CC
InChIInChI=1S/C20H48N2O2Si4/c1-12-21(13-2)20(22(14-3)15-4)25-16-17-27(8,9)24-28(10,11)19(7)26-23-18(5)6/h18-20H,12-17H2,1-11H3
InChIKeyAMEHLVUFMWQQFK-UHFFFAOYSA-N
MW460.96 g/mol
LogP4.89
Rot. Bonds16

About CID 172619330

CID 172619330 (PubChem CID 172619330) has the molecular formula C20H48N2O2Si4 and a molecular weight of 460.96 g/mol.

Molecular Properties

Compound NameCID 172619330
PubChem CID172619330
Molecular FormulaC20H48N2O2Si4
Molecular Weight460.96 g/mol
Exact Mass460.28
IUPAC Name
SMILESCCN(CC)C([Si]CC[Si](C)(C)O[Si](C)(C)C(C)[Si]OC(C)C)N(CC)CC
InChIInChI=1S/C20H48N2O2Si4/c1-12-21(13-2)20(22(14-3)15-4)25-16-17-27(8,9)24-28(10,11)19(7)26-23-18(5)6/h18-20H,12-17H2,1-11H3
InChIKeyAMEHLVUFMWQQFK-UHFFFAOYSA-N
XLogP4.89
TPSA24.94 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds16
Heavy Atoms28
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500460.96
LogP ≤ 54.89
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 172619330?
The IUPAC name of CID 172619330 (CID 172619330) is not available.
What is the SMILES notation for CID 172619330?
The canonical SMILES for CID 172619330 is CCN(CC)C([Si]CC[Si](C)(C)O[Si](C)(C)C(C)[Si]OC(C)C)N(CC)CC.
What is the InChIKey of CID 172619330?
The InChIKey is AMEHLVUFMWQQFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H48N2O2Si4/c1-12-21(13-2)20(22(14-3)15-4)25-16-17-27(8,9)24-28(10,11)19(7)26-23-18(5)6/h18-20H,12-17H2,1-11H3.
What are the key properties of CID 172619330?
CID 172619330 has a molecular weight of 460.96 g/mol, XLogP of 4.89, 16 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for CID 172619330 is sourced from PubChem (CID 172619330), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).