6-[6-aminohexyl(diethoxy)silyl]hexan-1-amine

C16H38N2O2Si — CID 139707876

IUPAC6-[6-aminohexyl(diethoxy)silyl]hexan-1-amine
SMILESCCO[Si](CCCCCCN)(CCCCCCN)OCC
InChIInChI=1S/C16H38N2O2Si/c1-3-19-21(20-4-2,15-11-7-5-9-13-17)16-12-8-6-10-14-18/h3-18H2,1-2H3
InChIKeyQPTPZIHFBJGSKT-UHFFFAOYSA-N
MW318.58 g/mol
LogP3.54
Rot. Bonds16

About 6-[6-aminohexyl(diethoxy)silyl]hexan-1-amine

6-[6-aminohexyl(diethoxy)silyl]hexan-1-amine (PubChem CID 139707876) has the molecular formula C16H38N2O2Si and a molecular weight of 318.58 g/mol. Its IUPAC name is 6-[6-aminohexyl(diethoxy)silyl]hexan-1-amine.

Molecular Properties

Compound Name6-[6-aminohexyl(diethoxy)silyl]hexan-1-amine
PubChem CID139707876
Molecular FormulaC16H38N2O2Si
Molecular Weight318.58 g/mol
Exact Mass318.27
IUPAC Name6-[6-aminohexyl(diethoxy)silyl]hexan-1-amine
SMILESCCO[Si](CCCCCCN)(CCCCCCN)OCC
InChIInChI=1S/C16H38N2O2Si/c1-3-19-21(20-4-2,15-11-7-5-9-13-17)16-12-8-6-10-14-18/h3-18H2,1-2H3
InChIKeyQPTPZIHFBJGSKT-UHFFFAOYSA-N
XLogP3.54
TPSA70.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds16
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.58
LogP ≤ 53.54
H-Bond Donors ≤ 52
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

4-[diethoxy(propyl)silyl]butan-1-amine
CID 139765357
36-triethoxysilylhexatriacontan-1-amine
CID 87683625
12-triethoxysilyldodecan-1-amine;hydrochloride
CID 175579282
diethoxy-heptadecyl-pentadecylsilane
CID 139614360
diethoxy-hexadecyl-tridecylsilane
CID 139614117
diethoxy-icosyl-undecylsilane
CID 139614143
decyl-diethoxy-tridecylsilane
CID 139614334
butyl-diethoxy-tetradecylsilane
CID 139614088
diethoxy-nonyl-propylsilane
CID 139614051
butoxy-ethoxy-dioctylsilane
CID 89350080
diethoxy-ethyl-hexacosylsilane
CID 153322873
11-[ethyl(dimethoxy)silyl]undecan-1-amine
CID 88501782

Frequently Asked Questions

What is the IUPAC name of 6-[6-aminohexyl(diethoxy)silyl]hexan-1-amine?
The IUPAC name of 6-[6-aminohexyl(diethoxy)silyl]hexan-1-amine (CID 139707876) is 6-[6-aminohexyl(diethoxy)silyl]hexan-1-amine.
What is the SMILES notation for 6-[6-aminohexyl(diethoxy)silyl]hexan-1-amine?
The canonical SMILES for 6-[6-aminohexyl(diethoxy)silyl]hexan-1-amine is CCO[Si](CCCCCCN)(CCCCCCN)OCC.
What is the InChIKey of 6-[6-aminohexyl(diethoxy)silyl]hexan-1-amine?
The InChIKey is QPTPZIHFBJGSKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H38N2O2Si/c1-3-19-21(20-4-2,15-11-7-5-9-13-17)16-12-8-6-10-14-18/h3-18H2,1-2H3.
What are the key properties of 6-[6-aminohexyl(diethoxy)silyl]hexan-1-amine?
6-[6-aminohexyl(diethoxy)silyl]hexan-1-amine has a molecular weight of 318.58 g/mol, XLogP of 3.54, 16 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[6-aminohexyl(diethoxy)silyl]hexan-1-amine is sourced from PubChem (CID 139707876), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).