N-dimethoxysilyl-2-ethyl-N-(2-ethylhexyl)hexan-1-amine

C18H41NO2Si — CID 131722118

IUPACN-dimethoxysilyl-2-ethyl-N-(2-ethylhexyl)hexan-1-amine
SMILESCCCCC(CC)CN(CC(CC)CCCC)[SiH](OC)OC
InChIInChI=1S/C18H41NO2Si/c1-7-11-13-17(9-3)15-19(22(20-5)21-6)16-18(10-4)14-12-8-2/h17-18,22H,7-16H2,1-6H3
InChIKeyOWTJYTHMUALIDS-UHFFFAOYSA-N
MW331.62 g/mol
LogP4.73
Rot. Bonds15

About N-dimethoxysilyl-2-ethyl-N-(2-ethylhexyl)hexan-1-amine

N-dimethoxysilyl-2-ethyl-N-(2-ethylhexyl)hexan-1-amine (PubChem CID 131722118) has the molecular formula C18H41NO2Si and a molecular weight of 331.62 g/mol. Its IUPAC name is N-dimethoxysilyl-2-ethyl-N-(2-ethylhexyl)hexan-1-amine.

Molecular Properties

Compound NameN-dimethoxysilyl-2-ethyl-N-(2-ethylhexyl)hexan-1-amine
PubChem CID131722118
Molecular FormulaC18H41NO2Si
Molecular Weight331.62 g/mol
Exact Mass331.29
IUPAC NameN-dimethoxysilyl-2-ethyl-N-(2-ethylhexyl)hexan-1-amine
SMILESCCCCC(CC)CN(CC(CC)CCCC)[SiH](OC)OC
InChIInChI=1S/C18H41NO2Si/c1-7-11-13-17(9-3)15-19(22(20-5)21-6)16-18(10-4)14-12-8-2/h17-18,22H,7-16H2,1-6H3
InChIKeyOWTJYTHMUALIDS-UHFFFAOYSA-N
XLogP4.73
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds15
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.62
LogP ≤ 54.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

1,1,2,2-tetrakis(2-ethylhexyl)hydrazine
CID 123650144
2-ethyl-N,N-bis(2-ethylhexyl)hexan-1-amine;hydrochloride
CID 23468552
(2S)-N,N-dibutyl-2-ethylhexan-1-amine
CID 40541425
2-ethyl-N-(2-ethylhexyl)-N-heptan-3-ylhexan-1-amine
CID 170537476
[bis(2-ethylhexyl)amino]oxymethanedithioic acid
CID 87721490
1-N',1-N'-bis(2-ethylhexyl)propane-1,1-diamine
CID 23135069
methyl 2-[2-ethylhexyl(methyl)amino]acetate
CID 62026323
2-[2-ethylhexyl(2-hydroxyethoxy)amino]oxyethanol
CID 87223542
2-[2-ethylhexyl(pentan-3-yl)amino]ethanol
CID 55191905
(3R)-3-[[(2R)-2-ethylhexoxy]methyl]heptane
CID 91827254
3-(difluoromethoxymethyl)heptane
CID 162429038
2-ethyl-N,N-dimethylundecan-1-amine
CID 87794341

Frequently Asked Questions

What is the IUPAC name of N-dimethoxysilyl-2-ethyl-N-(2-ethylhexyl)hexan-1-amine?
The IUPAC name of N-dimethoxysilyl-2-ethyl-N-(2-ethylhexyl)hexan-1-amine (CID 131722118) is N-dimethoxysilyl-2-ethyl-N-(2-ethylhexyl)hexan-1-amine.
What is the SMILES notation for N-dimethoxysilyl-2-ethyl-N-(2-ethylhexyl)hexan-1-amine?
The canonical SMILES for N-dimethoxysilyl-2-ethyl-N-(2-ethylhexyl)hexan-1-amine is CCCCC(CC)CN(CC(CC)CCCC)[SiH](OC)OC.
What is the InChIKey of N-dimethoxysilyl-2-ethyl-N-(2-ethylhexyl)hexan-1-amine?
The InChIKey is OWTJYTHMUALIDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H41NO2Si/c1-7-11-13-17(9-3)15-19(22(20-5)21-6)16-18(10-4)14-12-8-2/h17-18,22H,7-16H2,1-6H3.
What are the key properties of N-dimethoxysilyl-2-ethyl-N-(2-ethylhexyl)hexan-1-amine?
N-dimethoxysilyl-2-ethyl-N-(2-ethylhexyl)hexan-1-amine has a molecular weight of 331.62 g/mol, XLogP of 4.73, 15 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-dimethoxysilyl-2-ethyl-N-(2-ethylhexyl)hexan-1-amine is sourced from PubChem (CID 131722118), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).