N-[dimethoxy(propyl)silyl]-N-octyloctan-1-amine

C21H47NO2Si — CID 54243095

IUPACN-[dimethoxy(propyl)silyl]-N-octyloctan-1-amine
SMILESCCCCCCCCN(CCCCCCCC)[Si](CCC)(OC)OC
InChIInChI=1S/C21H47NO2Si/c1-6-9-11-13-15-17-19-22(20-18-16-14-12-10-7-2)25(23-4,24-5)21-8-3/h6-21H2,1-5H3
InChIKeyQRJONONMYIDEIE-UHFFFAOYSA-N
MW373.70 g/mol
LogP6.65
Rot. Bonds19

About N-[dimethoxy(propyl)silyl]-N-octyloctan-1-amine

N-[dimethoxy(propyl)silyl]-N-octyloctan-1-amine (PubChem CID 54243095) has the molecular formula C21H47NO2Si and a molecular weight of 373.70 g/mol. Its IUPAC name is N-[dimethoxy(propyl)silyl]-N-octyloctan-1-amine.

Molecular Properties

Compound NameN-[dimethoxy(propyl)silyl]-N-octyloctan-1-amine
PubChem CID54243095
Molecular FormulaC21H47NO2Si
Molecular Weight373.70 g/mol
Exact Mass373.34
IUPAC NameN-[dimethoxy(propyl)silyl]-N-octyloctan-1-amine
SMILESCCCCCCCCN(CCCCCCCC)[Si](CCC)(OC)OC
InChIInChI=1S/C21H47NO2Si/c1-6-9-11-13-15-17-19-22(20-18-16-14-12-10-7-2)25(23-4,24-5)21-8-3/h6-21H2,1-5H3
InChIKeyQRJONONMYIDEIE-UHFFFAOYSA-N
XLogP6.65
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds19
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500373.70
LogP ≤ 56.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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-[dimethoxy(2-methylpropyl)silyl]-N-hexylhexan-1-amine
CID 142705863
N-[(dihexylamino)-dimethoxysilyl]-N-hexylhexan-1-amine
CID 139816206
N-[(dipentylamino)-dimethoxysilyl]-N-pentylpentan-1-amine
CID 139816210
N-[butyl(dimethoxy)silyl]-N-ethylethanamine
CID 87635051
N-propyl-N-trimethoxysilyloctadecan-1-amine;hydrochloride
CID 173034322
N-methyl-N-(3-trimethoxysilylpropyl)decan-1-amine;hydroiodide
CID 174161924
hexacosyl(trimethoxy)silane
CID 150262252
hexane;bis(hexyl(trimethoxy)silane)
CID 175053771
trimethoxy(pentacontyl)silane
CID 87930715
dodecyl(trimethoxy)silane;octane
CID 174570785
decyl(trimethoxy)silane;hexyl(trimethoxy)silane
CID 22665206
(Z)-N-propyl-N-trimethoxysilyloctadec-9-en-1-amine;hydrochloride
CID 173241581

Frequently Asked Questions

What is the IUPAC name of N-[dimethoxy(propyl)silyl]-N-octyloctan-1-amine?
The IUPAC name of N-[dimethoxy(propyl)silyl]-N-octyloctan-1-amine (CID 54243095) is N-[dimethoxy(propyl)silyl]-N-octyloctan-1-amine.
What is the SMILES notation for N-[dimethoxy(propyl)silyl]-N-octyloctan-1-amine?
The canonical SMILES for N-[dimethoxy(propyl)silyl]-N-octyloctan-1-amine is CCCCCCCCN(CCCCCCCC)[Si](CCC)(OC)OC.
What is the InChIKey of N-[dimethoxy(propyl)silyl]-N-octyloctan-1-amine?
The InChIKey is QRJONONMYIDEIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H47NO2Si/c1-6-9-11-13-15-17-19-22(20-18-16-14-12-10-7-2)25(23-4,24-5)21-8-3/h6-21H2,1-5H3.
What are the key properties of N-[dimethoxy(propyl)silyl]-N-octyloctan-1-amine?
N-[dimethoxy(propyl)silyl]-N-octyloctan-1-amine has a molecular weight of 373.70 g/mol, XLogP of 6.65, 19 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[dimethoxy(propyl)silyl]-N-octyloctan-1-amine is sourced from PubChem (CID 54243095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).