2-[[diethoxy(hexyl)silyl]methyl]-N,N,N',N',2-pentamethylpropane-1,3-diamine

C19H44N2O2Si — CID 140647315

IUPAC2-[[diethoxy(hexyl)silyl]methyl]-N,N,N',N',2-pentamethylpropane-1,3-diamine
SMILESCCCCCC[Si](CC(C)(CN(C)C)CN(C)C)(OCC)OCC
InChIInChI=1S/C19H44N2O2Si/c1-9-12-13-14-15-24(22-10-2,23-11-3)18-19(4,16-20(5)6)17-21(7)8/h9-18H2,1-8H3
InChIKeyZXCPETLJOHXQDI-UHFFFAOYSA-N
MW360.66 g/mol
LogP4.21
Rot. Bonds15

About 2-[[diethoxy(hexyl)silyl]methyl]-N,N,N',N',2-pentamethylpropane-1,3-diamine

2-[[diethoxy(hexyl)silyl]methyl]-N,N,N',N',2-pentamethylpropane-1,3-diamine (PubChem CID 140647315) has the molecular formula C19H44N2O2Si and a molecular weight of 360.66 g/mol. Its IUPAC name is 2-[[diethoxy(hexyl)silyl]methyl]-N,N,N',N',2-pentamethylpropane-1,3-diamine.

Molecular Properties

Compound Name2-[[diethoxy(hexyl)silyl]methyl]-N,N,N',N',2-pentamethylpropane-1,3-diamine
PubChem CID140647315
Molecular FormulaC19H44N2O2Si
Molecular Weight360.66 g/mol
Exact Mass360.32
IUPAC Name2-[[diethoxy(hexyl)silyl]methyl]-N,N,N',N',2-pentamethylpropane-1,3-diamine
SMILESCCCCCC[Si](CC(C)(CN(C)C)CN(C)C)(OCC)OCC
InChIInChI=1S/C19H44N2O2Si/c1-9-12-13-14-15-24(22-10-2,23-11-3)18-19(4,16-20(5)6)17-21(7)8/h9-18H2,1-8H3
InChIKeyZXCPETLJOHXQDI-UHFFFAOYSA-N
XLogP4.21
TPSA24.94 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds15
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.66
LogP ≤ 54.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-[[diethoxy(hexyl)silyl]methyl]-2-ethyl-N,N,N',N'-tetramethylpropane-1,3-diamine
CID 140647272
diethoxy-heptadecyl-pentadecylsilane
CID 139614360
diethoxy-hexadecyl-tridecylsilane
CID 139614117
diethoxy-icosyl-undecylsilane
CID 139614143
decyl-diethoxy-tridecylsilane
CID 139614334
2-[(ethyl-hexyl-methoxysilyl)methyl]-N,N,N',N',2-pentamethylpropane-1,3-diamine
CID 140647706
butyl-diethoxy-tetradecylsilane
CID 139614088
diethoxy-ethyl-tetradecylsilane
CID 139614055
diethoxy-ethyl-hexacosylsilane
CID 153322873
diethoxy-nonyl-propylsilane
CID 139614051
butoxy-ethoxy-dioctylsilane
CID 89350080
ethoxy-methoxy-propyl-tetradecylsilane
CID 141078244

Frequently Asked Questions

What is the IUPAC name of 2-[[diethoxy(hexyl)silyl]methyl]-N,N,N',N',2-pentamethylpropane-1,3-diamine?
The IUPAC name of 2-[[diethoxy(hexyl)silyl]methyl]-N,N,N',N',2-pentamethylpropane-1,3-diamine (CID 140647315) is 2-[[diethoxy(hexyl)silyl]methyl]-N,N,N',N',2-pentamethylpropane-1,3-diamine.
What is the SMILES notation for 2-[[diethoxy(hexyl)silyl]methyl]-N,N,N',N',2-pentamethylpropane-1,3-diamine?
The canonical SMILES for 2-[[diethoxy(hexyl)silyl]methyl]-N,N,N',N',2-pentamethylpropane-1,3-diamine is CCCCCC[Si](CC(C)(CN(C)C)CN(C)C)(OCC)OCC.
What is the InChIKey of 2-[[diethoxy(hexyl)silyl]methyl]-N,N,N',N',2-pentamethylpropane-1,3-diamine?
The InChIKey is ZXCPETLJOHXQDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H44N2O2Si/c1-9-12-13-14-15-24(22-10-2,23-11-3)18-19(4,16-20(5)6)17-21(7)8/h9-18H2,1-8H3.
What are the key properties of 2-[[diethoxy(hexyl)silyl]methyl]-N,N,N',N',2-pentamethylpropane-1,3-diamine?
2-[[diethoxy(hexyl)silyl]methyl]-N,N,N',N',2-pentamethylpropane-1,3-diamine has a molecular weight of 360.66 g/mol, XLogP of 4.21, 15 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[diethoxy(hexyl)silyl]methyl]-N,N,N',N',2-pentamethylpropane-1,3-diamine is sourced from PubChem (CID 140647315), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).