(3,3-dimethylthiomorpholin-4-yl)methyl-trimethylsilane

C10H23NSSi — CID 127013251

IUPAC(3,3-dimethylthiomorpholin-4-yl)methyl-trimethylsilane
SMILESCC1(C)CSCCN1C[Si](C)(C)C
InChIInChI=1S/C10H23NSSi/c1-10(2)8-12-7-6-11(10)9-13(3,4)5/h6-9H2,1-5H3
InChIKeyNRALJBWYUQXJOH-UHFFFAOYSA-N
MW217.45 g/mol
LogP2.69
Rot. Bonds2

About (3,3-dimethylthiomorpholin-4-yl)methyl-trimethylsilane

(3,3-dimethylthiomorpholin-4-yl)methyl-trimethylsilane (PubChem CID 127013251) has the molecular formula C10H23NSSi and a molecular weight of 217.45 g/mol. Its IUPAC name is (3,3-dimethylthiomorpholin-4-yl)methyl-trimethylsilane.

Molecular Properties

Compound Name(3,3-dimethylthiomorpholin-4-yl)methyl-trimethylsilane
PubChem CID127013251
Molecular FormulaC10H23NSSi
Molecular Weight217.45 g/mol
Exact Mass217.13
IUPAC Name(3,3-dimethylthiomorpholin-4-yl)methyl-trimethylsilane
SMILESCC1(C)CSCCN1C[Si](C)(C)C
InChIInChI=1S/C10H23NSSi/c1-10(2)8-12-7-6-11(10)9-13(3,4)5/h6-9H2,1-5H3
InChIKeyNRALJBWYUQXJOH-UHFFFAOYSA-N
XLogP2.69
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.45
LogP ≤ 52.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

3,3-dimethyl-4-propylthiomorpholine
CID 130685619
3,3-dimethyl-4-propan-2-ylthiomorpholine
CID 130717092
1-(3,3-dimethylthiomorpholin-4-yl)-2-hydroxyethanone
CID 130688632
4-[3-(3-fluorophenyl)propyl]-3,3-dimethylthiomorpholine
CID 99799922
3,3-dimethyl-4-methylsulfonylthiomorpholine
CID 130677346
N-(cyanomethyl)-N-(3,3-dimethylthiomorpholin-4-yl)nitrous amide
CID 22363312
(4,4-dimethyl-3-morpholin-4-ylthian-3-yl)methanamine
CID 79948892
tert-butyl-[[3-[[tert-butyl(dimethyl)silyl]oxymethyl]thiolan-3-yl]methoxy]-dimethylsilane
CID 11710579
(3-ethylthiolan-3-yl)methanol
CID 146230443
3,3-dimethyl-4-(thiomorpholin-3-ylmethyl)morpholine
CID 82917179
4-[[4-(bromomethyl)oxan-4-yl]methyl]thiomorpholine
CID 65004698
(2-methyl-1,4-oxathian-2-yl)methanamine
CID 155821418

Frequently Asked Questions

What is the IUPAC name of (3,3-dimethylthiomorpholin-4-yl)methyl-trimethylsilane?
The IUPAC name of (3,3-dimethylthiomorpholin-4-yl)methyl-trimethylsilane (CID 127013251) is (3,3-dimethylthiomorpholin-4-yl)methyl-trimethylsilane.
What is the SMILES notation for (3,3-dimethylthiomorpholin-4-yl)methyl-trimethylsilane?
The canonical SMILES for (3,3-dimethylthiomorpholin-4-yl)methyl-trimethylsilane is CC1(C)CSCCN1C[Si](C)(C)C.
What is the InChIKey of (3,3-dimethylthiomorpholin-4-yl)methyl-trimethylsilane?
The InChIKey is NRALJBWYUQXJOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23NSSi/c1-10(2)8-12-7-6-11(10)9-13(3,4)5/h6-9H2,1-5H3.
What are the key properties of (3,3-dimethylthiomorpholin-4-yl)methyl-trimethylsilane?
(3,3-dimethylthiomorpholin-4-yl)methyl-trimethylsilane has a molecular weight of 217.45 g/mol, XLogP of 2.69, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3,3-dimethylthiomorpholin-4-yl)methyl-trimethylsilane is sourced from PubChem (CID 127013251), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).