N-(2-trimethoxysilylethyl)hexan-1-amine

C11H27NO3Si — CID 87738268

IUPACN-(2-trimethoxysilylethyl)hexan-1-amine
SMILESCCCCCCNCC[Si](OC)(OC)OC
InChIInChI=1S/C11H27NO3Si/c1-5-6-7-8-9-12-10-11-16(13-2,14-3)15-4/h12H,5-11H2,1-4H3
InChIKeyPTLHQGRVCANUIC-UHFFFAOYSA-N
MW249.43 g/mol
LogP2.03
Rot. Bonds11

About N-(2-trimethoxysilylethyl)hexan-1-amine

N-(2-trimethoxysilylethyl)hexan-1-amine (PubChem CID 87738268) has the molecular formula C11H27NO3Si and a molecular weight of 249.43 g/mol. Its IUPAC name is N-(2-trimethoxysilylethyl)hexan-1-amine.

Molecular Properties

Compound NameN-(2-trimethoxysilylethyl)hexan-1-amine
PubChem CID87738268
Molecular FormulaC11H27NO3Si
Molecular Weight249.43 g/mol
Exact Mass249.18
IUPAC NameN-(2-trimethoxysilylethyl)hexan-1-amine
SMILESCCCCCCNCC[Si](OC)(OC)OC
InChIInChI=1S/C11H27NO3Si/c1-5-6-7-8-9-12-10-11-16(13-2,14-3)15-4/h12H,5-11H2,1-4H3
InChIKeyPTLHQGRVCANUIC-UHFFFAOYSA-N
XLogP2.03
TPSA39.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds11
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.43
LogP ≤ 52.03
H-Bond Donors ≤ 51
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

N-hexyltridecan-1-amine
CID 87659278
octane;N-octylnonan-1-amine
CID 145152206
N-undecyltetradecan-1-amine
CID 166059375
N,N'-diheptyldecane-1,10-diamine
CID 3028161
N,N'-diheptylhexane-1,6-diamine
CID 3028571
hexane;bis(hexyl(trimethoxy)silane)
CID 175053771
trimethoxy(pentacontyl)silane
CID 87930715
hexacosyl(trimethoxy)silane
CID 150262252
decyl(trimethoxy)silane;hexyl(trimethoxy)silane
CID 22665206
dodecyl(trimethoxy)silane;octane
CID 174570785
N'-(8-trimethoxysilyloctyl)ethane-1,2-diamine
CID 132554515
N-(2-trihydroxysilylethyl)octan-1-amine
CID 87683408

Frequently Asked Questions

What is the IUPAC name of N-(2-trimethoxysilylethyl)hexan-1-amine?
The IUPAC name of N-(2-trimethoxysilylethyl)hexan-1-amine (CID 87738268) is N-(2-trimethoxysilylethyl)hexan-1-amine.
What is the SMILES notation for N-(2-trimethoxysilylethyl)hexan-1-amine?
The canonical SMILES for N-(2-trimethoxysilylethyl)hexan-1-amine is CCCCCCNCC[Si](OC)(OC)OC.
What is the InChIKey of N-(2-trimethoxysilylethyl)hexan-1-amine?
The InChIKey is PTLHQGRVCANUIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H27NO3Si/c1-5-6-7-8-9-12-10-11-16(13-2,14-3)15-4/h12H,5-11H2,1-4H3.
What are the key properties of N-(2-trimethoxysilylethyl)hexan-1-amine?
N-(2-trimethoxysilylethyl)hexan-1-amine has a molecular weight of 249.43 g/mol, XLogP of 2.03, 11 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-trimethoxysilylethyl)hexan-1-amine is sourced from PubChem (CID 87738268), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).