CID 6396541

C16H26N2Si — CID 6396541

IUPAC—
SMILESCC(C)(C)CN1[Si]N(CC(C)(C)C)c2ccccc21
InChIInChI=1S/C16H26N2Si/c1-15(2,3)11-17-13-9-7-8-10-14(13)18(19-17)12-16(4,5)6/h7-10H,11-12H2,1-6H3
InChIKeyZRGLQXRAVHCEAA-UHFFFAOYSA-N
MW274.48 g/mol
LogP3.94
Rot. Bonds2

About CID 6396541

CID 6396541 (PubChem CID 6396541) has the molecular formula C16H26N2Si and a molecular weight of 274.48 g/mol.

Molecular Properties

Compound NameCID 6396541
PubChem CID6396541
Molecular FormulaC16H26N2Si
Molecular Weight274.48 g/mol
Exact Mass274.19
IUPAC Name—
SMILESCC(C)(C)CN1[Si]N(CC(C)(C)C)c2ccccc21
InChIInChI=1S/C16H26N2Si/c1-15(2,3)11-17-13-9-7-8-10-14(13)18(19-17)12-16(4,5)6/h7-10H,11-12H2,1-6H3
InChIKeyZRGLQXRAVHCEAA-UHFFFAOYSA-N
XLogP3.94
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.48
LogP ≤ 53.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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 6396541?
The IUPAC name of CID 6396541 (CID 6396541) is not available.
What is the SMILES notation for CID 6396541?
The canonical SMILES for CID 6396541 is CC(C)(C)CN1[Si]N(CC(C)(C)C)c2ccccc21.
What is the InChIKey of CID 6396541?
The InChIKey is ZRGLQXRAVHCEAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2Si/c1-15(2,3)11-17-13-9-7-8-10-14(13)18(19-17)12-16(4,5)6/h7-10H,11-12H2,1-6H3.
What are the key properties of CID 6396541?
CID 6396541 has a molecular weight of 274.48 g/mol, XLogP of 3.94, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 6396541 is sourced from PubChem (CID 6396541), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).