(NE)-N-[[1-(2-trimethylsilylethoxymethyl)imidazol-2-yl]methylidene]hydroxylamine

C10H19N3O2Si — CID 140658225

IUPAC(NE)-N-[[1-(2-trimethylsilylethoxymethyl)imidazol-2-yl]methylidene]hydroxylamine
SMILESC[Si](C)(C)CCOCn1ccnc1/C=N/O
InChIInChI=1S/C10H19N3O2Si/c1-16(2,3)7-6-15-9-13-5-4-11-10(13)8-12-14/h4-5,8,14H,6-7,9H2,1-3H3/b12-8+
InChIKeyAEENDLLVCUQUNQ-XYOKQWHBSA-N
MW241.37 g/mol
LogP2.00
Rot. Bonds6

About (NE)-N-[[1-(2-trimethylsilylethoxymethyl)imidazol-2-yl]methylidene]hydroxylamine

(NE)-N-[[1-(2-trimethylsilylethoxymethyl)imidazol-2-yl]methylidene]hydroxylamine (PubChem CID 140658225) has the molecular formula C10H19N3O2Si and a molecular weight of 241.37 g/mol. Its IUPAC name is (NE)-N-[[1-(2-trimethylsilylethoxymethyl)imidazol-2-yl]methylidene]hydroxylamine.

Molecular Properties

Compound Name(NE)-N-[[1-(2-trimethylsilylethoxymethyl)imidazol-2-yl]methylidene]hydroxylamine
PubChem CID140658225
Molecular FormulaC10H19N3O2Si
Molecular Weight241.37 g/mol
Exact Mass241.12
IUPAC Name(NE)-N-[[1-(2-trimethylsilylethoxymethyl)imidazol-2-yl]methylidene]hydroxylamine
SMILESC[Si](C)(C)CCOCn1ccnc1/C=N/O
InChIInChI=1S/C10H19N3O2Si/c1-16(2,3)7-6-15-9-13-5-4-11-10(13)8-12-14/h4-5,8,14H,6-7,9H2,1-3H3/b12-8+
InChIKeyAEENDLLVCUQUNQ-XYOKQWHBSA-N
XLogP2.00
TPSA59.64 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.37
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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': 'oxime_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-methyl-1-(2-trimethylsilylethoxymethyl)imidazol-2-amine
CID 155615799
1-(2-trimethylsilylethoxymethyl)imidazole-2-carboxamide
CID 68592326
(NE)-N-[[1-(3-bromopropyl)imidazol-2-yl]methylidene]hydroxylamine
CID 136951143
(NE)-N-[[1-(2-morpholin-4-ylethyl)imidazol-2-yl]methylidene]hydroxylamine
CID 140737146
3-[1-(2-trimethylsilylethoxymethyl)imidazol-2-yl]-2-[[1-(2-trimethylsilylethoxymethyl)imidazol-2-yl]methyl]propan-1-ol
CID 68954118
(NZ)-N-[(1-prop-2-ynylimidazol-2-yl)methylidene]hydroxylamine
CID 137395527
2-[[2-(4-iodophenyl)imidazol-1-yl]methoxy]ethyl-trimethylsilane
CID 59276562
phenyl-[1-(2-trimethylsilylethoxymethyl)imidazol-2-yl]methanone
CID 174251990
(4,6-dichloro-5-fluoro-3-pyridinyl)-[1-(2-trimethylsilylethoxymethyl)imidazol-2-yl]methanone
CID 155711450
2-(hydroxymethyl)-3-[1-(2-trimethylsilylethoxymethyl)imidazol-2-yl]-2-[[1-(2-trimethylsilylethoxymethyl)imidazol-2-yl]methyl]propanenitrile
CID 68956045
trimethyl-[2-[[2-[4-(trifluoromethyl)phenyl]imidazol-1-yl]methoxy]ethyl]silane
CID 150281377
(3,3-difluorocyclobutyl)-[1-(2-trimethylsilylethoxymethyl)imidazol-2-yl]methanone
CID 164860021

Frequently Asked Questions

What is the IUPAC name of (NE)-N-[[1-(2-trimethylsilylethoxymethyl)imidazol-2-yl]methylidene]hydroxylamine?
The IUPAC name of (NE)-N-[[1-(2-trimethylsilylethoxymethyl)imidazol-2-yl]methylidene]hydroxylamine (CID 140658225) is (NE)-N-[[1-(2-trimethylsilylethoxymethyl)imidazol-2-yl]methylidene]hydroxylamine.
What is the SMILES notation for (NE)-N-[[1-(2-trimethylsilylethoxymethyl)imidazol-2-yl]methylidene]hydroxylamine?
The canonical SMILES for (NE)-N-[[1-(2-trimethylsilylethoxymethyl)imidazol-2-yl]methylidene]hydroxylamine is C[Si](C)(C)CCOCn1ccnc1/C=N/O.
What is the InChIKey of (NE)-N-[[1-(2-trimethylsilylethoxymethyl)imidazol-2-yl]methylidene]hydroxylamine?
The InChIKey is AEENDLLVCUQUNQ-XYOKQWHBSA-N. The full InChI is InChI=1S/C10H19N3O2Si/c1-16(2,3)7-6-15-9-13-5-4-11-10(13)8-12-14/h4-5,8,14H,6-7,9H2,1-3H3/b12-8+.
What are the key properties of (NE)-N-[[1-(2-trimethylsilylethoxymethyl)imidazol-2-yl]methylidene]hydroxylamine?
(NE)-N-[[1-(2-trimethylsilylethoxymethyl)imidazol-2-yl]methylidene]hydroxylamine has a molecular weight of 241.37 g/mol, XLogP of 2.00, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (NE)-N-[[1-(2-trimethylsilylethoxymethyl)imidazol-2-yl]methylidene]hydroxylamine is sourced from PubChem (CID 140658225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).