trimethylsilyl N-[5-(trimethylsilyloxycarbonylamino)pentyl]carbamate

C13H30N2O4Si2 — CID 174061171

IUPACtrimethylsilyl N-[5-(trimethylsilyloxycarbonylamino)pentyl]carbamate
SMILESC[Si](C)(C)OC(=O)NCCCCCNC(=O)O[Si](C)(C)C
InChIInChI=1S/C13H30N2O4Si2/c1-20(2,3)18-12(16)14-10-8-7-9-11-15-13(17)19-21(4,5)6/h7-11H2,1-6H3,(H,14,16)(H,15,17)
InChIKeyJSDVVXDLOLCXKJ-UHFFFAOYSA-N
MW334.57 g/mol
LogP3.28
Rot. Bonds8

About trimethylsilyl N-[5-(trimethylsilyloxycarbonylamino)pentyl]carbamate

trimethylsilyl N-[5-(trimethylsilyloxycarbonylamino)pentyl]carbamate (PubChem CID 174061171) has the molecular formula C13H30N2O4Si2 and a molecular weight of 334.57 g/mol. Its IUPAC name is trimethylsilyl N-[5-(trimethylsilyloxycarbonylamino)pentyl]carbamate.

Molecular Properties

Compound Nametrimethylsilyl N-[5-(trimethylsilyloxycarbonylamino)pentyl]carbamate
PubChem CID174061171
Molecular FormulaC13H30N2O4Si2
Molecular Weight334.57 g/mol
Exact Mass334.17
IUPAC Nametrimethylsilyl N-[5-(trimethylsilyloxycarbonylamino)pentyl]carbamate
SMILESC[Si](C)(C)OC(=O)NCCCCCNC(=O)O[Si](C)(C)C
InChIInChI=1S/C13H30N2O4Si2/c1-20(2,3)18-12(16)14-10-8-7-9-11-15-13(17)19-21(4,5)6/h7-11H2,1-6H3,(H,14,16)(H,15,17)
InChIKeyJSDVVXDLOLCXKJ-UHFFFAOYSA-N
XLogP3.28
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.57
LogP ≤ 53.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of trimethylsilyl N-[5-(trimethylsilyloxycarbonylamino)pentyl]carbamate?
The IUPAC name of trimethylsilyl N-[5-(trimethylsilyloxycarbonylamino)pentyl]carbamate (CID 174061171) is trimethylsilyl N-[5-(trimethylsilyloxycarbonylamino)pentyl]carbamate.
What is the SMILES notation for trimethylsilyl N-[5-(trimethylsilyloxycarbonylamino)pentyl]carbamate?
The canonical SMILES for trimethylsilyl N-[5-(trimethylsilyloxycarbonylamino)pentyl]carbamate is C[Si](C)(C)OC(=O)NCCCCCNC(=O)O[Si](C)(C)C.
What is the InChIKey of trimethylsilyl N-[5-(trimethylsilyloxycarbonylamino)pentyl]carbamate?
The InChIKey is JSDVVXDLOLCXKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H30N2O4Si2/c1-20(2,3)18-12(16)14-10-8-7-9-11-15-13(17)19-21(4,5)6/h7-11H2,1-6H3,(H,14,16)(H,15,17).
What are the key properties of trimethylsilyl N-[5-(trimethylsilyloxycarbonylamino)pentyl]carbamate?
trimethylsilyl N-[5-(trimethylsilyloxycarbonylamino)pentyl]carbamate has a molecular weight of 334.57 g/mol, XLogP of 3.28, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for trimethylsilyl N-[5-(trimethylsilyloxycarbonylamino)pentyl]carbamate is sourced from PubChem (CID 174061171), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).