3-[tert-butyl(dimethyl)silyl]oxypropylthiourea

C10H24N2OSSi — CID 155592862

IUPAC3-[tert-butyl(dimethyl)silyl]oxypropylthiourea
SMILESCC(C)(C)[Si](C)(C)OCCCNC(N)=S
InChIInChI=1S/C10H24N2OSSi/c1-10(2,3)15(4,5)13-8-6-7-12-9(11)14/h6-8H2,1-5H3,(H3,11,12,14)
InChIKeyDDAHDVSBRUAREG-UHFFFAOYSA-N
MW248.47 g/mol
LogP2.23
Rot. Bonds5

About 3-[tert-butyl(dimethyl)silyl]oxypropylthiourea

3-[tert-butyl(dimethyl)silyl]oxypropylthiourea (PubChem CID 155592862) has the molecular formula C10H24N2OSSi and a molecular weight of 248.47 g/mol. Its IUPAC name is 3-[tert-butyl(dimethyl)silyl]oxypropylthiourea.

Molecular Properties

Compound Name3-[tert-butyl(dimethyl)silyl]oxypropylthiourea
PubChem CID155592862
Molecular FormulaC10H24N2OSSi
Molecular Weight248.47 g/mol
Exact Mass248.14
IUPAC Name3-[tert-butyl(dimethyl)silyl]oxypropylthiourea
SMILESCC(C)(C)[Si](C)(C)OCCCNC(N)=S
InChIInChI=1S/C10H24N2OSSi/c1-10(2,3)15(4,5)13-8-6-7-12-9(11)14/h6-8H2,1-5H3,(H3,11,12,14)
InChIKeyDDAHDVSBRUAREG-UHFFFAOYSA-N
XLogP2.23
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.47
LogP ≤ 52.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 3-[tert-butyl(dimethyl)silyl]oxypropylthiourea with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-[3-(carbamothioylamino)propoxy]propylthiourea
CID 88722493
tert-butyl-[6-[tert-butyl(dimethyl)silyl]oxyhexoxy]-dimethylsilane
CID 6430202
tert-butyl-[5-[tert-butyl(dimethyl)silyl]oxypentoxy]-dimethylsilane
CID 529127
tert-butyl-[10-[tert-butyl(dimethyl)silyl]oxydecoxy]-dimethylsilane
CID 6430197
2-bromo-N-[5-[tert-butyl(dimethyl)silyl]oxypentyl]acetamide
CID 170899815
2-[tert-butyl(dimethyl)silyl]oxyethylhydrazine
CID 57142085
2-[tert-butyl(dimethyl)silyl]oxy-N-[2-[tert-butyl(dimethyl)silyl]oxyethyl]ethanamine
CID 11427595
22-[tert-butyl(dimethyl)silyl]oxydocosan-1-ol
CID 15229755
8-[tert-butyl(dimethyl)silyl]oxyoctan-1-ol
CID 11043515
1-[3-[tert-butyl(dimethyl)silyl]oxypropyl]-3-(2-phenylethyl)urea
CID 155933037
tert-butyl-(4,4-dimethylpentoxy)-dimethylsilane
CID 59819312
azane;butoxy-tert-butyl-dimethylsilane
CID 87971025

Frequently Asked Questions

What is the IUPAC name of 3-[tert-butyl(dimethyl)silyl]oxypropylthiourea?
The IUPAC name of 3-[tert-butyl(dimethyl)silyl]oxypropylthiourea (CID 155592862) is 3-[tert-butyl(dimethyl)silyl]oxypropylthiourea.
What is the SMILES notation for 3-[tert-butyl(dimethyl)silyl]oxypropylthiourea?
The canonical SMILES for 3-[tert-butyl(dimethyl)silyl]oxypropylthiourea is CC(C)(C)[Si](C)(C)OCCCNC(N)=S.
What is the InChIKey of 3-[tert-butyl(dimethyl)silyl]oxypropylthiourea?
The InChIKey is DDAHDVSBRUAREG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H24N2OSSi/c1-10(2,3)15(4,5)13-8-6-7-12-9(11)14/h6-8H2,1-5H3,(H3,11,12,14).
What are the key properties of 3-[tert-butyl(dimethyl)silyl]oxypropylthiourea?
3-[tert-butyl(dimethyl)silyl]oxypropylthiourea has a molecular weight of 248.47 g/mol, XLogP of 2.23, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[tert-butyl(dimethyl)silyl]oxypropylthiourea is sourced from PubChem (CID 155592862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).