trimethyl-[[(2S,3R)-1-methyl-3-thiophen-2-ylazaphosphiridin-2-yl]-trimethylsilylmethyl]silane

C13H26NPSSi2 — CID 139161353

IUPACtrimethyl-[[(2S,3R)-1-methyl-3-thiophen-2-ylazaphosphiridin-2-yl]-trimethylsilylmethyl]silane
SMILESCN1[C@@H](c2cccs2)[P@@]1C([Si](C)(C)C)[Si](C)(C)C
InChIInChI=1S/C13H26NPSSi2/c1-14-12(11-9-8-10-16-11)15(14)13(17(2,3)4)18(5,6)7/h8-10,12-13H,1-7H3/t12-,14?,15+/m1/s1
InChIKeyLEZIYPCLQKXZRA-ATFAPYMMSA-N
MW315.57 g/mol
LogP5.21
Rot. Bonds4

About trimethyl-[[(2S,3R)-1-methyl-3-thiophen-2-ylazaphosphiridin-2-yl]-trimethylsilylmethyl]silane

trimethyl-[[(2S,3R)-1-methyl-3-thiophen-2-ylazaphosphiridin-2-yl]-trimethylsilylmethyl]silane (PubChem CID 139161353) has the molecular formula C13H26NPSSi2 and a molecular weight of 315.57 g/mol. Its IUPAC name is trimethyl-[[(2S,3R)-1-methyl-3-thiophen-2-ylazaphosphiridin-2-yl]-trimethylsilylmethyl]silane.

Molecular Properties

Compound Nametrimethyl-[[(2S,3R)-1-methyl-3-thiophen-2-ylazaphosphiridin-2-yl]-trimethylsilylmethyl]silane
PubChem CID139161353
Molecular FormulaC13H26NPSSi2
Molecular Weight315.57 g/mol
Exact Mass315.11
IUPAC Nametrimethyl-[[(2S,3R)-1-methyl-3-thiophen-2-ylazaphosphiridin-2-yl]-trimethylsilylmethyl]silane
SMILESCN1[C@@H](c2cccs2)[P@@]1C([Si](C)(C)C)[Si](C)(C)C
InChIInChI=1S/C13H26NPSSi2/c1-14-12(11-9-8-10-16-11)15(14)13(17(2,3)4)18(5,6)7/h8-10,12-13H,1-7H3/t12-,14?,15+/m1/s1
InChIKeyLEZIYPCLQKXZRA-ATFAPYMMSA-N
XLogP5.21
TPSA3.01 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500315.57
LogP ≤ 55.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}, {'alert_name': 'Three-membered_heterocycle', 'substructure': 'N/A'}

Analyze trimethyl-[[(2S,3R)-1-methyl-3-thiophen-2-ylazaphosphiridin-2-yl]-trimethylsilylmethyl]silane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of trimethyl-[[(2S,3R)-1-methyl-3-thiophen-2-ylazaphosphiridin-2-yl]-trimethylsilylmethyl]silane?
The IUPAC name of trimethyl-[[(2S,3R)-1-methyl-3-thiophen-2-ylazaphosphiridin-2-yl]-trimethylsilylmethyl]silane (CID 139161353) is trimethyl-[[(2S,3R)-1-methyl-3-thiophen-2-ylazaphosphiridin-2-yl]-trimethylsilylmethyl]silane.
What is the SMILES notation for trimethyl-[[(2S,3R)-1-methyl-3-thiophen-2-ylazaphosphiridin-2-yl]-trimethylsilylmethyl]silane?
The canonical SMILES for trimethyl-[[(2S,3R)-1-methyl-3-thiophen-2-ylazaphosphiridin-2-yl]-trimethylsilylmethyl]silane is CN1[C@@H](c2cccs2)[P@@]1C([Si](C)(C)C)[Si](C)(C)C.
What is the InChIKey of trimethyl-[[(2S,3R)-1-methyl-3-thiophen-2-ylazaphosphiridin-2-yl]-trimethylsilylmethyl]silane?
The InChIKey is LEZIYPCLQKXZRA-ATFAPYMMSA-N. The full InChI is InChI=1S/C13H26NPSSi2/c1-14-12(11-9-8-10-16-11)15(14)13(17(2,3)4)18(5,6)7/h8-10,12-13H,1-7H3/t12-,14?,15+/m1/s1.
What are the key properties of trimethyl-[[(2S,3R)-1-methyl-3-thiophen-2-ylazaphosphiridin-2-yl]-trimethylsilylmethyl]silane?
trimethyl-[[(2S,3R)-1-methyl-3-thiophen-2-ylazaphosphiridin-2-yl]-trimethylsilylmethyl]silane has a molecular weight of 315.57 g/mol, XLogP of 5.21, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[[(2S,3R)-1-methyl-3-thiophen-2-ylazaphosphiridin-2-yl]-trimethylsilylmethyl]silane is sourced from PubChem (CID 139161353), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).