1-dimethoxysilylethylurea

C5H14N2O3Si — CID 154078118

IUPAC1-dimethoxysilylethylurea
SMILESCO[SiH](OC)C(C)NC(N)=O
InChIInChI=1S/C5H14N2O3Si/c1-4(7-5(6)8)11(9-2)10-3/h4,11H,1-3H3,(H3,6,7,8)
InChIKeyWHSRXQWMRZIJCU-UHFFFAOYSA-N
MW178.26 g/mol
LogP-0.90
Rot. Bonds4

About 1-dimethoxysilylethylurea

1-dimethoxysilylethylurea (PubChem CID 154078118) has the molecular formula C5H14N2O3Si and a molecular weight of 178.26 g/mol. Its IUPAC name is 1-dimethoxysilylethylurea.

Molecular Properties

Compound Name1-dimethoxysilylethylurea
PubChem CID154078118
Molecular FormulaC5H14N2O3Si
Molecular Weight178.26 g/mol
Exact Mass178.08
IUPAC Name1-dimethoxysilylethylurea
SMILESCO[SiH](OC)C(C)NC(N)=O
InChIInChI=1S/C5H14N2O3Si/c1-4(7-5(6)8)11(9-2)10-3/h4,11H,1-3H3,(H3,6,7,8)
InChIKeyWHSRXQWMRZIJCU-UHFFFAOYSA-N
XLogP-0.90
TPSA73.58 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.26
LogP ≤ 5-0.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

(2-dimethoxysilyl-2-ethoxyethyl)urea
CID 173093903
[1-(carbamoylamino)-2-methylpropyl]urea
CID 22478
methyl (2R)-2-hydroxypropanoate;methyl (2S)-2-hydroxypropanoate
CID 76960533
[(2R)-1-(carbamoylamino)propan-2-yl]urea
CID 3246036
(5-amino-5-dimethoxysilylpentyl)urea
CID 175187119
methyl 2-(carbamoylamino)-3-hydroxypropanoate
CID 43311462
1-(dimethylamino)ethylurea
CID 169101887
methyl (2R)-2-acetamidopropanoate
CID 6951031
methanol;methyl 2-hydroxypropanoate
CID 157321309
methyl (2S)-2-hydroxypropanoate;hydrochloride
CID 88631623
methyl 2-hydroxypropanoate;hydrochloride
CID 87417627
1-ethenoxyethylurea
CID 19078685

Frequently Asked Questions

What is the IUPAC name of 1-dimethoxysilylethylurea?
The IUPAC name of 1-dimethoxysilylethylurea (CID 154078118) is 1-dimethoxysilylethylurea.
What is the SMILES notation for 1-dimethoxysilylethylurea?
The canonical SMILES for 1-dimethoxysilylethylurea is CO[SiH](OC)C(C)NC(N)=O.
What is the InChIKey of 1-dimethoxysilylethylurea?
The InChIKey is WHSRXQWMRZIJCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H14N2O3Si/c1-4(7-5(6)8)11(9-2)10-3/h4,11H,1-3H3,(H3,6,7,8).
What are the key properties of 1-dimethoxysilylethylurea?
1-dimethoxysilylethylurea has a molecular weight of 178.26 g/mol, XLogP of -0.90, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-dimethoxysilylethylurea is sourced from PubChem (CID 154078118), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).