bis(chloromethyl)-dimethylsilane;(E)-N-[[dimethyl-[[(E)-1-(6-methyl-2-pyridinyl)ethylideneamino]oxymethyl]silyl]methoxy]-1-(6-methyl-2-pyridinyl)ethanimine;(NE)-N-[1-(6-methyl-2-pyridinyl)ethylidene]hydroxylamine

C32H48Cl2N6O3Si2 — CID 172966086

IUPACbis(chloromethyl)-dimethylsilane;(E)-N-[[dimethyl-[[(E)-1-(6-methyl-2-pyridinyl)ethylideneamino]oxymethyl]silyl]methoxy]-1-(6-methyl-2-pyridinyl)ethanimine;(NE)-N-[1-(6-methyl-2-pyridinyl)ethylidene]hydroxylamine
SMILESC/C(=N\O)c1cccc(C)n1.C/C(=N\OC[Si](C)(C)CO/N=C(\C)c1cccc(C)n1)c1cccc(C)n1.C[Si](C)(CCl)CCl
InChIInChI=1S/C20H28N4O2Si.C8H10N2O.C4H10Cl2Si/c1-15-9-7-11-19(21-15)17(3)23-25-13-27(5,6)14-26-24-18(4)20-12-8-10-16(2)22-20;1-6-4-3-5-8(9-6)7(2)10-11;1-7(2,3-5)4-6/h7-12H,13-14H2,1-6H3;3-5,11H,1-2H3;3-4H2,1-2H3/b23-17+,24-18+;10-7+;
InChIKeyGAWLUMLDPOTGIX-BUOCDRSESA-N
MW691.85 g/mol
LogP7.90
Rot. Bonds11

About bis(chloromethyl)-dimethylsilane;(E)-N-[[dimethyl-[[(E)-1-(6-methyl-2-pyridinyl)ethylideneamino]oxymethyl]silyl]methoxy]-1-(6-methyl-2-pyridinyl)ethanimine;(NE)-N-[1-(6-methyl-2-pyridinyl)ethylidene]hydroxylamine

bis(chloromethyl)-dimethylsilane;(E)-N-[[dimethyl-[[(E)-1-(6-methyl-2-pyridinyl)ethylideneamino]oxymethyl]silyl]methoxy]-1-(6-methyl-2-pyridinyl)ethanimine;(NE)-N-[1-(6-methyl-2-pyridinyl)ethylidene]hydroxylamine (PubChem CID 172966086) has the molecular formula C32H48Cl2N6O3Si2 and a molecular weight of 691.85 g/mol. Its IUPAC name is bis(chloromethyl)-dimethylsilane;(E)-N-[[dimethyl-[[(E)-1-(6-methyl-2-pyridinyl)ethylideneamino]oxymethyl]silyl]methoxy]-1-(6-methyl-2-pyridinyl)ethanimine;(NE)-N-[1-(6-methyl-2-pyridinyl)ethylidene]hydroxylamine.

Molecular Properties

Compound Namebis(chloromethyl)-dimethylsilane;(E)-N-[[dimethyl-[[(E)-1-(6-methyl-2-pyridinyl)ethylideneamino]oxymethyl]silyl]methoxy]-1-(6-methyl-2-pyridinyl)ethanimine;(NE)-N-[1-(6-methyl-2-pyridinyl)ethylidene]hydroxylamine
PubChem CID172966086
Molecular FormulaC32H48Cl2N6O3Si2
Molecular Weight691.85 g/mol
Exact Mass690.27
IUPAC Namebis(chloromethyl)-dimethylsilane;(E)-N-[[dimethyl-[[(E)-1-(6-methyl-2-pyridinyl)ethylideneamino]oxymethyl]silyl]methoxy]-1-(6-methyl-2-pyridinyl)ethanimine;(NE)-N-[1-(6-methyl-2-pyridinyl)ethylidene]hydroxylamine
SMILESC/C(=N\O)c1cccc(C)n1.C/C(=N\OC[Si](C)(C)CO/N=C(\C)c1cccc(C)n1)c1cccc(C)n1.C[Si](C)(CCl)CCl
InChIInChI=1S/C20H28N4O2Si.C8H10N2O.C4H10Cl2Si/c1-15-9-7-11-19(21-15)17(3)23-25-13-27(5,6)14-26-24-18(4)20-12-8-10-16(2)22-20;1-6-4-3-5-8(9-6)7(2)10-11;1-7(2,3-5)4-6/h7-12H,13-14H2,1-6H3;3-5,11H,1-2H3;3-4H2,1-2H3/b23-17+,24-18+;10-7+;
InChIKeyGAWLUMLDPOTGIX-BUOCDRSESA-N
XLogP7.90
TPSA114.44 Ų
H-Bond Donors1
H-Bond Acceptors9
Rotatable Bonds11
Heavy Atoms45
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500691.85
LogP ≤ 57.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 109

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'oxime_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze bis(chloromethyl)-dimethylsilane;(E)-N-[[dimethyl-[[(E)-1-(6-methyl-2-pyridinyl)ethylideneamino]oxymethyl]silyl]methoxy]-1-(6-methyl-2-pyridinyl)ethanimine;(NE)-N-[1-(6-methyl-2-pyridinyl)ethylidene]hydroxylamine with MolForge

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Related Compounds

(E)-1-(6-methyl-2-pyridinyl)-N-[(E)-1-(6-methyl-2-pyridinyl)ethylideneamino]ethanimine
CID 50989515
N-[3-[6-(N-methoxy-C-methylcarbonimidoyl)-2-pyridinyl]propoxy]-1-(6-methyl-2-pyridinyl)ethanimine
CID 123636438
N-methoxy-1-[6-[4-[1-(6-methyl-2-pyridinyl)ethylideneamino]oxybut-1-en-2-yl]-2-pyridinyl]ethanimine
CID 123316303
6-[3-[1-(6-methyl-2-pyridinyl)ethylideneamino]oxypropyl]pyridin-2-amine
CID 123349027
3-[(E)-1-(6-methyl-2-pyridinyl)ethylideneamino]oxypropanal;3-[(E)-1-(6-methyl-2-pyridinyl)ethylideneamino]oxypropan-1-ol
CID 172961316
1-[6-[3-[(Z)-1-(6-methyl-2-pyridinyl)ethylideneamino]oxyprop-1-ynyl]-2-pyridinyl]ethanone
CID 131741413
(Z)-N-[3-(6-bromo-2-pyridinyl)prop-2-ynoxy]-1-(6-methyl-2-pyridinyl)ethanimine
CID 131740882
2-[6-[3-[(E)-1-(6-methyl-2-pyridinyl)ethylideneamino]oxypropyl]-2-pyridinyl]acetaldehyde
CID 87170194
6-[3-[(E)-1-(6-methyl-2-pyridinyl)ethylideneamino]oxypropyl]pyridine-2-carbaldehyde
CID 87170147
1-[6-(2-methyl-1,3-dioxolan-2-yl)-2-pyridinyl]-3-[(E)-1-(6-methyl-2-pyridinyl)ethylideneamino]oxypropan-1-one
CID 87170943
N-[1-(6-ethoxy-2-pyridinyl)ethylidene]hydroxylamine
CID 142476631
1-[6-[(Z)-N-hydroxy-C-methylcarbonimidoyl]-2-pyridinyl]ethanone
CID 136803768

Frequently Asked Questions

What is the IUPAC name of bis(chloromethyl)-dimethylsilane;(E)-N-[[dimethyl-[[(E)-1-(6-methyl-2-pyridinyl)ethylideneamino]oxymethyl]silyl]methoxy]-1-(6-methyl-2-pyridinyl)ethanimine;(NE)-N-[1-(6-methyl-2-pyridinyl)ethylidene]hydroxylamine?
The IUPAC name of bis(chloromethyl)-dimethylsilane;(E)-N-[[dimethyl-[[(E)-1-(6-methyl-2-pyridinyl)ethylideneamino]oxymethyl]silyl]methoxy]-1-(6-methyl-2-pyridinyl)ethanimine;(NE)-N-[1-(6-methyl-2-pyridinyl)ethylidene]hydroxylamine (CID 172966086) is bis(chloromethyl)-dimethylsilane;(E)-N-[[dimethyl-[[(E)-1-(6-methyl-2-pyridinyl)ethylideneamino]oxymethyl]silyl]methoxy]-1-(6-methyl-2-pyridinyl)ethanimine;(NE)-N-[1-(6-methyl-2-pyridinyl)ethylidene]hydroxylamine.
What is the SMILES notation for bis(chloromethyl)-dimethylsilane;(E)-N-[[dimethyl-[[(E)-1-(6-methyl-2-pyridinyl)ethylideneamino]oxymethyl]silyl]methoxy]-1-(6-methyl-2-pyridinyl)ethanimine;(NE)-N-[1-(6-methyl-2-pyridinyl)ethylidene]hydroxylamine?
The canonical SMILES for bis(chloromethyl)-dimethylsilane;(E)-N-[[dimethyl-[[(E)-1-(6-methyl-2-pyridinyl)ethylideneamino]oxymethyl]silyl]methoxy]-1-(6-methyl-2-pyridinyl)ethanimine;(NE)-N-[1-(6-methyl-2-pyridinyl)ethylidene]hydroxylamine is C/C(=N\O)c1cccc(C)n1.C/C(=N\OC[Si](C)(C)CO/N=C(\C)c1cccc(C)n1)c1cccc(C)n1.C[Si](C)(CCl)CCl.
What is the InChIKey of bis(chloromethyl)-dimethylsilane;(E)-N-[[dimethyl-[[(E)-1-(6-methyl-2-pyridinyl)ethylideneamino]oxymethyl]silyl]methoxy]-1-(6-methyl-2-pyridinyl)ethanimine;(NE)-N-[1-(6-methyl-2-pyridinyl)ethylidene]hydroxylamine?
The InChIKey is GAWLUMLDPOTGIX-BUOCDRSESA-N. The full InChI is InChI=1S/C20H28N4O2Si.C8H10N2O.C4H10Cl2Si/c1-15-9-7-11-19(21-15)17(3)23-25-13-27(5,6)14-26-24-18(4)20-12-8-10-16(2)22-20;1-6-4-3-5-8(9-6)7(2)10-11;1-7(2,3-5)4-6/h7-12H,13-14H2,1-6H3;3-5,11H,1-2H3;3-4H2,1-2H3/b23-17+,24-18+;10-7+;.
What are the key properties of bis(chloromethyl)-dimethylsilane;(E)-N-[[dimethyl-[[(E)-1-(6-methyl-2-pyridinyl)ethylideneamino]oxymethyl]silyl]methoxy]-1-(6-methyl-2-pyridinyl)ethanimine;(NE)-N-[1-(6-methyl-2-pyridinyl)ethylidene]hydroxylamine?
bis(chloromethyl)-dimethylsilane;(E)-N-[[dimethyl-[[(E)-1-(6-methyl-2-pyridinyl)ethylideneamino]oxymethyl]silyl]methoxy]-1-(6-methyl-2-pyridinyl)ethanimine;(NE)-N-[1-(6-methyl-2-pyridinyl)ethylidene]hydroxylamine has a molecular weight of 691.85 g/mol, XLogP of 7.90, 11 rotatable bonds, 1 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for bis(chloromethyl)-dimethylsilane;(E)-N-[[dimethyl-[[(E)-1-(6-methyl-2-pyridinyl)ethylideneamino]oxymethyl]silyl]methoxy]-1-(6-methyl-2-pyridinyl)ethanimine;(NE)-N-[1-(6-methyl-2-pyridinyl)ethylidene]hydroxylamine is sourced from PubChem (CID 172966086), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).