(Z)-N-(trimethylsilylmethoxy)butan-2-imine

C8H19NOSi — CID 102437237

IUPAC(Z)-N-(trimethylsilylmethoxy)butan-2-imine
SMILESCC/C(C)=N\OC[Si](C)(C)C
InChIInChI=1S/C8H19NOSi/c1-6-8(2)9-10-7-11(3,4)5/h6-7H2,1-5H3/b9-8-
InChIKeySSUBLAWEMHWXDC-HJWRWDBZSA-N
MW173.33 g/mol
LogP2.67
Rot. Bonds4

About (Z)-N-(trimethylsilylmethoxy)butan-2-imine

(Z)-N-(trimethylsilylmethoxy)butan-2-imine (PubChem CID 102437237) has the molecular formula C8H19NOSi and a molecular weight of 173.33 g/mol. Its IUPAC name is (Z)-N-(trimethylsilylmethoxy)butan-2-imine.

Molecular Properties

Compound Name(Z)-N-(trimethylsilylmethoxy)butan-2-imine
PubChem CID102437237
Molecular FormulaC8H19NOSi
Molecular Weight173.33 g/mol
Exact Mass173.12
IUPAC Name(Z)-N-(trimethylsilylmethoxy)butan-2-imine
SMILESCC/C(C)=N\OC[Si](C)(C)C
InChIInChI=1S/C8H19NOSi/c1-6-8(2)9-10-7-11(3,4)5/h6-7H2,1-5H3/b9-8-
InChIKeySSUBLAWEMHWXDC-HJWRWDBZSA-N
XLogP2.67
TPSA21.59 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.33
LogP ≤ 52.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (Z)-N-(trimethylsilylmethoxy)butan-2-imine?
The IUPAC name of (Z)-N-(trimethylsilylmethoxy)butan-2-imine (CID 102437237) is (Z)-N-(trimethylsilylmethoxy)butan-2-imine.
What is the SMILES notation for (Z)-N-(trimethylsilylmethoxy)butan-2-imine?
The canonical SMILES for (Z)-N-(trimethylsilylmethoxy)butan-2-imine is CC/C(C)=N\OC[Si](C)(C)C.
What is the InChIKey of (Z)-N-(trimethylsilylmethoxy)butan-2-imine?
The InChIKey is SSUBLAWEMHWXDC-HJWRWDBZSA-N. The full InChI is InChI=1S/C8H19NOSi/c1-6-8(2)9-10-7-11(3,4)5/h6-7H2,1-5H3/b9-8-.
What are the key properties of (Z)-N-(trimethylsilylmethoxy)butan-2-imine?
(Z)-N-(trimethylsilylmethoxy)butan-2-imine has a molecular weight of 173.33 g/mol, XLogP of 2.67, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N-(trimethylsilylmethoxy)butan-2-imine is sourced from PubChem (CID 102437237), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).