N-(methylideneamino)-N-(2-trimethylsilylethoxymethyl)ethanimidamide

C9H21N3OSi — CID 174024899

IUPACN-(methylideneamino)-N-(2-trimethylsilylethoxymethyl)ethanimidamide
SMILES[H]/N=C(\C)N(COCC[Si](C)(C)C)N=C
InChIInChI=1S/C9H21N3OSi/c1-9(10)12(11-2)8-13-6-7-14(3,4)5/h10H,2,6-8H2,1,3-5H3/b10-9+
InChIKeyJIMWNUFAHTUFMB-MDZDMXLPSA-N
MW215.37 g/mol
LogP2.21
Rot. Bonds6

About N-(methylideneamino)-N-(2-trimethylsilylethoxymethyl)ethanimidamide

N-(methylideneamino)-N-(2-trimethylsilylethoxymethyl)ethanimidamide (PubChem CID 174024899) has the molecular formula C9H21N3OSi and a molecular weight of 215.37 g/mol. Its IUPAC name is N-(methylideneamino)-N-(2-trimethylsilylethoxymethyl)ethanimidamide.

Molecular Properties

Compound NameN-(methylideneamino)-N-(2-trimethylsilylethoxymethyl)ethanimidamide
PubChem CID174024899
Molecular FormulaC9H21N3OSi
Molecular Weight215.37 g/mol
Exact Mass215.15
IUPAC NameN-(methylideneamino)-N-(2-trimethylsilylethoxymethyl)ethanimidamide
SMILES[H]/N=C(\C)N(COCC[Si](C)(C)C)N=C
InChIInChI=1S/C9H21N3OSi/c1-9(10)12(11-2)8-13-6-7-14(3,4)5/h10H,2,6-8H2,1,3-5H3/b10-9+
InChIKeyJIMWNUFAHTUFMB-MDZDMXLPSA-N
XLogP2.21
TPSA48.68 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.37
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', '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 N-(methylideneamino)-N-(2-trimethylsilylethoxymethyl)ethanimidamide?
The IUPAC name of N-(methylideneamino)-N-(2-trimethylsilylethoxymethyl)ethanimidamide (CID 174024899) is N-(methylideneamino)-N-(2-trimethylsilylethoxymethyl)ethanimidamide.
What is the SMILES notation for N-(methylideneamino)-N-(2-trimethylsilylethoxymethyl)ethanimidamide?
The canonical SMILES for N-(methylideneamino)-N-(2-trimethylsilylethoxymethyl)ethanimidamide is [H]/N=C(\C)N(COCC[Si](C)(C)C)N=C.
What is the InChIKey of N-(methylideneamino)-N-(2-trimethylsilylethoxymethyl)ethanimidamide?
The InChIKey is JIMWNUFAHTUFMB-MDZDMXLPSA-N. The full InChI is InChI=1S/C9H21N3OSi/c1-9(10)12(11-2)8-13-6-7-14(3,4)5/h10H,2,6-8H2,1,3-5H3/b10-9+.
What are the key properties of N-(methylideneamino)-N-(2-trimethylsilylethoxymethyl)ethanimidamide?
N-(methylideneamino)-N-(2-trimethylsilylethoxymethyl)ethanimidamide has a molecular weight of 215.37 g/mol, XLogP of 2.21, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(methylideneamino)-N-(2-trimethylsilylethoxymethyl)ethanimidamide is sourced from PubChem (CID 174024899), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).