N-(4,4-diethoxybut-1-enylsilyl)-N-methylmethanamine

C10H23NO2Si — CID 154083260

IUPACN-(4,4-diethoxybut-1-enylsilyl)-N-methylmethanamine
SMILESCCOC(CC=C[SiH2]N(C)C)OCC
InChIInChI=1S/C10H23NO2Si/c1-5-12-10(13-6-2)8-7-9-14-11(3)4/h7,9-10H,5-6,8,14H2,1-4H3
InChIKeyMRLOIESCLGCEEE-UHFFFAOYSA-N
MW217.38 g/mol
LogP0.93
Rot. Bonds8

About N-(4,4-diethoxybut-1-enylsilyl)-N-methylmethanamine

N-(4,4-diethoxybut-1-enylsilyl)-N-methylmethanamine (PubChem CID 154083260) has the molecular formula C10H23NO2Si and a molecular weight of 217.38 g/mol. Its IUPAC name is N-(4,4-diethoxybut-1-enylsilyl)-N-methylmethanamine.

Molecular Properties

Compound NameN-(4,4-diethoxybut-1-enylsilyl)-N-methylmethanamine
PubChem CID154083260
Molecular FormulaC10H23NO2Si
Molecular Weight217.38 g/mol
Exact Mass217.15
IUPAC NameN-(4,4-diethoxybut-1-enylsilyl)-N-methylmethanamine
SMILESCCOC(CC=C[SiH2]N(C)C)OCC
InChIInChI=1S/C10H23NO2Si/c1-5-12-10(13-6-2)8-7-9-14-11(3)4/h7,9-10H,5-6,8,14H2,1-4H3
InChIKeyMRLOIESCLGCEEE-UHFFFAOYSA-N
XLogP0.93
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.38
LogP ≤ 50.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

N-(4,4-dimethoxybut-1-enylsilyl)-N-methylmethanamine
CID 154083244
N-(4,4-diethoxybut-1-enylsilyl)-N-ethylethanamine
CID 154083246
N-(4,4-dimethoxybut-1-enylsilyl)-N-ethylethanamine
CID 154083248
N-(3,3-diethoxyprop-1-enylsilyl)-N-methylmethanamine
CID 154083249
4,4-Diethoxybut-1-enylsilane
CID 154359973
1,1-Diethoxybut-3-en-2-ylsilane
CID 173204911

Frequently Asked Questions

What is the IUPAC name of N-(4,4-diethoxybut-1-enylsilyl)-N-methylmethanamine?
The IUPAC name of N-(4,4-diethoxybut-1-enylsilyl)-N-methylmethanamine (CID 154083260) is N-(4,4-diethoxybut-1-enylsilyl)-N-methylmethanamine.
What is the SMILES notation for N-(4,4-diethoxybut-1-enylsilyl)-N-methylmethanamine?
The canonical SMILES for N-(4,4-diethoxybut-1-enylsilyl)-N-methylmethanamine is CCOC(CC=C[SiH2]N(C)C)OCC.
What is the InChIKey of N-(4,4-diethoxybut-1-enylsilyl)-N-methylmethanamine?
The InChIKey is MRLOIESCLGCEEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23NO2Si/c1-5-12-10(13-6-2)8-7-9-14-11(3)4/h7,9-10H,5-6,8,14H2,1-4H3.
What are the key properties of N-(4,4-diethoxybut-1-enylsilyl)-N-methylmethanamine?
N-(4,4-diethoxybut-1-enylsilyl)-N-methylmethanamine has a molecular weight of 217.38 g/mol, XLogP of 0.93, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4,4-diethoxybut-1-enylsilyl)-N-methylmethanamine is sourced from PubChem (CID 154083260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).