2-[2-[tert-butyl(diphenyl)silyl]oxyethyl]guanidine

C19H27N3OSi — CID 25020569

IUPAC2-[2-[tert-butyl(diphenyl)silyl]oxyethyl]guanidine
SMILESCC(C)(C)[Si](OCCN=C(N)N)(c1ccccc1)c1ccccc1
InChIInChI=1S/C19H27N3OSi/c1-19(2,3)24(16-10-6-4-7-11-16,17-12-8-5-9-13-17)23-15-14-22-18(20)21/h4-13H,14-15H2,1-3H3,(H4,20,21,22)
InChIKeyRCCZQTUFYURZJD-UHFFFAOYSA-N
MW341.53 g/mol
LogP1.84
Rot. Bonds6

About 2-[2-[tert-butyl(diphenyl)silyl]oxyethyl]guanidine

2-[2-[tert-butyl(diphenyl)silyl]oxyethyl]guanidine (PubChem CID 25020569) has the molecular formula C19H27N3OSi and a molecular weight of 341.53 g/mol. Its IUPAC name is 2-[2-[tert-butyl(diphenyl)silyl]oxyethyl]guanidine.

Molecular Properties

Compound Name2-[2-[tert-butyl(diphenyl)silyl]oxyethyl]guanidine
PubChem CID25020569
Molecular FormulaC19H27N3OSi
Molecular Weight341.53 g/mol
Exact Mass341.19
IUPAC Name2-[2-[tert-butyl(diphenyl)silyl]oxyethyl]guanidine
SMILESCC(C)(C)[Si](OCCN=C(N)N)(c1ccccc1)c1ccccc1
InChIInChI=1S/C19H27N3OSi/c1-19(2,3)24(16-10-6-4-7-11-16,17-12-8-5-9-13-17)23-15-14-22-18(20)21/h4-13H,14-15H2,1-3H3,(H4,20,21,22)
InChIKeyRCCZQTUFYURZJD-UHFFFAOYSA-N
XLogP1.84
TPSA73.63 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.53
LogP ≤ 51.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-[2-[tert-butyl(diphenyl)silyl]oxyethyl]guanidine?
The IUPAC name of 2-[2-[tert-butyl(diphenyl)silyl]oxyethyl]guanidine (CID 25020569) is 2-[2-[tert-butyl(diphenyl)silyl]oxyethyl]guanidine.
What is the SMILES notation for 2-[2-[tert-butyl(diphenyl)silyl]oxyethyl]guanidine?
The canonical SMILES for 2-[2-[tert-butyl(diphenyl)silyl]oxyethyl]guanidine is CC(C)(C)[Si](OCCN=C(N)N)(c1ccccc1)c1ccccc1.
What is the InChIKey of 2-[2-[tert-butyl(diphenyl)silyl]oxyethyl]guanidine?
The InChIKey is RCCZQTUFYURZJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H27N3OSi/c1-19(2,3)24(16-10-6-4-7-11-16,17-12-8-5-9-13-17)23-15-14-22-18(20)21/h4-13H,14-15H2,1-3H3,(H4,20,21,22).
What are the key properties of 2-[2-[tert-butyl(diphenyl)silyl]oxyethyl]guanidine?
2-[2-[tert-butyl(diphenyl)silyl]oxyethyl]guanidine has a molecular weight of 341.53 g/mol, XLogP of 1.84, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[tert-butyl(diphenyl)silyl]oxyethyl]guanidine is sourced from PubChem (CID 25020569), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).