N-[[dimethoxy(methyl)silyl]methyl]-2-propan-2-ylimidazole-1-carboxamide

C11H21N3O3Si — CID 69216651

IUPACN-[[dimethoxy(methyl)silyl]methyl]-2-propan-2-ylimidazole-1-carboxamide
SMILESCO[Si](C)(CNC(=O)n1ccnc1C(C)C)OC
InChIInChI=1S/C11H21N3O3Si/c1-9(2)10-12-6-7-14(10)11(15)13-8-18(5,16-3)17-4/h6-7,9H,8H2,1-5H3,(H,13,15)
InChIKeyRKAPXZYPQBGQTK-UHFFFAOYSA-N
MW271.39 g/mol
LogP1.47
Rot. Bonds5

About N-[[dimethoxy(methyl)silyl]methyl]-2-propan-2-ylimidazole-1-carboxamide

N-[[dimethoxy(methyl)silyl]methyl]-2-propan-2-ylimidazole-1-carboxamide (PubChem CID 69216651) has the molecular formula C11H21N3O3Si and a molecular weight of 271.39 g/mol. Its IUPAC name is N-[[dimethoxy(methyl)silyl]methyl]-2-propan-2-ylimidazole-1-carboxamide.

Molecular Properties

Compound NameN-[[dimethoxy(methyl)silyl]methyl]-2-propan-2-ylimidazole-1-carboxamide
PubChem CID69216651
Molecular FormulaC11H21N3O3Si
Molecular Weight271.39 g/mol
Exact Mass271.14
IUPAC NameN-[[dimethoxy(methyl)silyl]methyl]-2-propan-2-ylimidazole-1-carboxamide
SMILESCO[Si](C)(CNC(=O)n1ccnc1C(C)C)OC
InChIInChI=1S/C11H21N3O3Si/c1-9(2)10-12-6-7-14(10)11(15)13-8-18(5,16-3)17-4/h6-7,9H,8H2,1-5H3,(H,13,15)
InChIKeyRKAPXZYPQBGQTK-UHFFFAOYSA-N
XLogP1.47
TPSA65.38 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.39
LogP ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

methyl 2-propan-2-ylimidazole-1-carboxylate
CID 59953857
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methyl 2-phenyl-3-(2-propan-2-ylimidazol-1-yl)propanoate
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CID 64704256
1-(2-methoxyethoxymethyl)-2-propan-2-ylimidazole
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N-[4-[(2-methoxyacetyl)amino]phenyl]-2-(2-propan-2-ylimidazol-1-yl)propanamide
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CID 174993071

Frequently Asked Questions

What is the IUPAC name of N-[[dimethoxy(methyl)silyl]methyl]-2-propan-2-ylimidazole-1-carboxamide?
The IUPAC name of N-[[dimethoxy(methyl)silyl]methyl]-2-propan-2-ylimidazole-1-carboxamide (CID 69216651) is N-[[dimethoxy(methyl)silyl]methyl]-2-propan-2-ylimidazole-1-carboxamide.
What is the SMILES notation for N-[[dimethoxy(methyl)silyl]methyl]-2-propan-2-ylimidazole-1-carboxamide?
The canonical SMILES for N-[[dimethoxy(methyl)silyl]methyl]-2-propan-2-ylimidazole-1-carboxamide is CO[Si](C)(CNC(=O)n1ccnc1C(C)C)OC.
What is the InChIKey of N-[[dimethoxy(methyl)silyl]methyl]-2-propan-2-ylimidazole-1-carboxamide?
The InChIKey is RKAPXZYPQBGQTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3O3Si/c1-9(2)10-12-6-7-14(10)11(15)13-8-18(5,16-3)17-4/h6-7,9H,8H2,1-5H3,(H,13,15).
What are the key properties of N-[[dimethoxy(methyl)silyl]methyl]-2-propan-2-ylimidazole-1-carboxamide?
N-[[dimethoxy(methyl)silyl]methyl]-2-propan-2-ylimidazole-1-carboxamide has a molecular weight of 271.39 g/mol, XLogP of 1.47, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[dimethoxy(methyl)silyl]methyl]-2-propan-2-ylimidazole-1-carboxamide is sourced from PubChem (CID 69216651), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).