1-(2-trimethylsilylethoxymethyl)imidazole-2-carboxamide

C10H19N3O2Si — CID 68592326

IUPAC1-(2-trimethylsilylethoxymethyl)imidazole-2-carboxamide
SMILESC[Si](C)(C)CCOCn1ccnc1C(N)=O
InChIInChI=1S/C10H19N3O2Si/c1-16(2,3)7-6-15-8-13-5-4-12-10(13)9(11)14/h4-5H,6-8H2,1-3H3,(H2,11,14)
InChIKeyBKFLUXBQUHVWRH-UHFFFAOYSA-N
MW241.37 g/mol
LogP1.29
Rot. Bonds6

About 1-(2-trimethylsilylethoxymethyl)imidazole-2-carboxamide

1-(2-trimethylsilylethoxymethyl)imidazole-2-carboxamide (PubChem CID 68592326) has the molecular formula C10H19N3O2Si and a molecular weight of 241.37 g/mol. Its IUPAC name is 1-(2-trimethylsilylethoxymethyl)imidazole-2-carboxamide.

Molecular Properties

Compound Name1-(2-trimethylsilylethoxymethyl)imidazole-2-carboxamide
PubChem CID68592326
Molecular FormulaC10H19N3O2Si
Molecular Weight241.37 g/mol
Exact Mass241.12
IUPAC Name1-(2-trimethylsilylethoxymethyl)imidazole-2-carboxamide
SMILESC[Si](C)(C)CCOCn1ccnc1C(N)=O
InChIInChI=1S/C10H19N3O2Si/c1-16(2,3)7-6-15-8-13-5-4-12-10(13)9(11)14/h4-5H,6-8H2,1-3H3,(H2,11,14)
InChIKeyBKFLUXBQUHVWRH-UHFFFAOYSA-N
XLogP1.29
TPSA70.14 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.37
LogP ≤ 51.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

phenyl-[1-(2-trimethylsilylethoxymethyl)imidazol-2-yl]methanone
CID 174251990
(3,3-difluorocyclobutyl)-[1-(2-trimethylsilylethoxymethyl)imidazol-2-yl]methanone
CID 164860021
4-bromo-1-(2-trimethylsilylethoxymethyl)imidazole-2-carboxamide
CID 140827014
(4,6-dichloro-5-fluoro-3-pyridinyl)-[1-(2-trimethylsilylethoxymethyl)imidazol-2-yl]methanone
CID 155711450
N-methyl-1-(2-trimethylsilylethoxymethyl)imidazol-2-amine
CID 155615799
4-chloro-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridine-5-carboxamide
CID 71258387
(NE)-N-[[1-(2-trimethylsilylethoxymethyl)imidazol-2-yl]methylidene]hydroxylamine
CID 140658225
3-[1-(2-trimethylsilylethoxymethyl)imidazol-2-yl]-2-[[1-(2-trimethylsilylethoxymethyl)imidazol-2-yl]methyl]propan-1-ol
CID 68954118
2-[1-(2-trimethylsilylethoxymethyl)imidazol-2-yl]pyridine-4-carboxylic acid
CID 154665027
4-methyl-1-(2-trimethylsilylethoxymethyl)imidazole-2-carboxylic acid
CID 142729257
2-[[2-(4-iodophenyl)imidazol-1-yl]methoxy]ethyl-trimethylsilane
CID 59276562
tert-butyl 2-[1-(2-trimethylsilylethoxymethyl)imidazol-2-yl]pyrrolidine-1-carboxylate
CID 67201133

Frequently Asked Questions

What is the IUPAC name of 1-(2-trimethylsilylethoxymethyl)imidazole-2-carboxamide?
The IUPAC name of 1-(2-trimethylsilylethoxymethyl)imidazole-2-carboxamide (CID 68592326) is 1-(2-trimethylsilylethoxymethyl)imidazole-2-carboxamide.
What is the SMILES notation for 1-(2-trimethylsilylethoxymethyl)imidazole-2-carboxamide?
The canonical SMILES for 1-(2-trimethylsilylethoxymethyl)imidazole-2-carboxamide is C[Si](C)(C)CCOCn1ccnc1C(N)=O.
What is the InChIKey of 1-(2-trimethylsilylethoxymethyl)imidazole-2-carboxamide?
The InChIKey is BKFLUXBQUHVWRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N3O2Si/c1-16(2,3)7-6-15-8-13-5-4-12-10(13)9(11)14/h4-5H,6-8H2,1-3H3,(H2,11,14).
What are the key properties of 1-(2-trimethylsilylethoxymethyl)imidazole-2-carboxamide?
1-(2-trimethylsilylethoxymethyl)imidazole-2-carboxamide has a molecular weight of 241.37 g/mol, XLogP of 1.29, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-trimethylsilylethoxymethyl)imidazole-2-carboxamide is sourced from PubChem (CID 68592326), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).