ethoxy-(1-isocyanopropan-2-yloxy)-methyl-propylsilane

C10H21NO2Si — CID 159005238

IUPACethoxy-(1-isocyanopropan-2-yloxy)-methyl-propylsilane
SMILES[C-]#[N+]CC(C)O[Si](C)(CCC)OCC
InChIInChI=1S/C10H21NO2Si/c1-6-8-14(5,12-7-2)13-10(3)9-11-4/h10H,6-9H2,1-3,5H3
InChIKeyJRVKNBRPCGIUJO-UHFFFAOYSA-N
MW215.37 g/mol
LogP2.83
Rot. Bonds7

About ethoxy-(1-isocyanopropan-2-yloxy)-methyl-propylsilane

ethoxy-(1-isocyanopropan-2-yloxy)-methyl-propylsilane (PubChem CID 159005238) has the molecular formula C10H21NO2Si and a molecular weight of 215.37 g/mol. Its IUPAC name is ethoxy-(1-isocyanopropan-2-yloxy)-methyl-propylsilane.

Molecular Properties

Compound Nameethoxy-(1-isocyanopropan-2-yloxy)-methyl-propylsilane
PubChem CID159005238
Molecular FormulaC10H21NO2Si
Molecular Weight215.37 g/mol
Exact Mass215.13
IUPAC Nameethoxy-(1-isocyanopropan-2-yloxy)-methyl-propylsilane
SMILES[C-]#[N+]CC(C)O[Si](C)(CCC)OCC
InChIInChI=1S/C10H21NO2Si/c1-6-8-14(5,12-7-2)13-10(3)9-11-4/h10H,6-9H2,1-3,5H3
InChIKeyJRVKNBRPCGIUJO-UHFFFAOYSA-N
XLogP2.83
TPSA22.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.37
LogP ≤ 52.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1-bromoethoxy-ethoxy-methyl-propylsilane
CID 175044219
ethoxy-methyl-octyl-propan-2-yloxysilane
CID 175038920
ethoxy-methyl-(1-piperazin-1-ylethoxy)-propylsilane
CID 175455488
diethoxy-isocyano-pentan-2-yloxysilane
CID 141161615
1-(ethoxy-methoxy-propylsilyl)oxyethanamine
CID 87663977
1-(amino-ethoxy-propylsilyl)oxyethanamine
CID 175174366
3-(3-chloropropyl-ethoxy-methylsilyl)oxybutan-1-amine
CID 174395414
ethoxy-methyl-(1-morpholin-2-ylethoxy)-propylsilane
CID 174627480
butan-2-yloxy-dimethyl-propylsilane
CID 87645546
N'-[3-(3-aminopropyl-ethoxy-methylsilyl)oxybutyl]ethane-1,2-diamine
CID 141116193
[diethoxy(methyl)silyl]methyl-diethoxy-methylsilane
CID 13131406
3-[ethoxy-methyl-[1-(oxiran-2-yl)propan-2-yloxy]silyl]propan-1-ol
CID 154637990

Frequently Asked Questions

What is the IUPAC name of ethoxy-(1-isocyanopropan-2-yloxy)-methyl-propylsilane?
The IUPAC name of ethoxy-(1-isocyanopropan-2-yloxy)-methyl-propylsilane (CID 159005238) is ethoxy-(1-isocyanopropan-2-yloxy)-methyl-propylsilane.
What is the SMILES notation for ethoxy-(1-isocyanopropan-2-yloxy)-methyl-propylsilane?
The canonical SMILES for ethoxy-(1-isocyanopropan-2-yloxy)-methyl-propylsilane is [C-]#[N+]CC(C)O[Si](C)(CCC)OCC.
What is the InChIKey of ethoxy-(1-isocyanopropan-2-yloxy)-methyl-propylsilane?
The InChIKey is JRVKNBRPCGIUJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO2Si/c1-6-8-14(5,12-7-2)13-10(3)9-11-4/h10H,6-9H2,1-3,5H3.
What are the key properties of ethoxy-(1-isocyanopropan-2-yloxy)-methyl-propylsilane?
ethoxy-(1-isocyanopropan-2-yloxy)-methyl-propylsilane has a molecular weight of 215.37 g/mol, XLogP of 2.83, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethoxy-(1-isocyanopropan-2-yloxy)-methyl-propylsilane is sourced from PubChem (CID 159005238), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).