1-triethoxysilyldecan-1-amine

C16H37NO3Si — CID 87463354

IUPAC1-triethoxysilyldecan-1-amine
SMILESCCCCCCCCCC(N)[Si](OCC)(OCC)OCC
InChIInChI=1S/C16H37NO3Si/c1-5-9-10-11-12-13-14-15-16(17)21(18-6-2,19-7-3)20-8-4/h16H,5-15,17H2,1-4H3
InChIKeyBVHYFNKJTKOLAE-UHFFFAOYSA-N
MW319.56 g/mol
LogP4.04
Rot. Bonds15

About 1-triethoxysilyldecan-1-amine

1-triethoxysilyldecan-1-amine (PubChem CID 87463354) has the molecular formula C16H37NO3Si and a molecular weight of 319.56 g/mol. Its IUPAC name is 1-triethoxysilyldecan-1-amine.

Molecular Properties

Compound Name1-triethoxysilyldecan-1-amine
PubChem CID87463354
Molecular FormulaC16H37NO3Si
Molecular Weight319.56 g/mol
Exact Mass319.25
IUPAC Name1-triethoxysilyldecan-1-amine
SMILESCCCCCCCCCC(N)[Si](OCC)(OCC)OCC
InChIInChI=1S/C16H37NO3Si/c1-5-9-10-11-12-13-14-15-16(17)21(18-6-2,19-7-3)20-8-4/h16H,5-15,17H2,1-4H3
InChIKeyBVHYFNKJTKOLAE-UHFFFAOYSA-N
XLogP4.04
TPSA53.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds15
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.56
LogP ≤ 54.04
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

1-[diethoxy(methyl)silyl]heptan-1-amine
CID 174602385
1-trimethoxysilyloctan-1-amine
CID 87463125
4-methyl-1-triethoxysilylhexan-1-amine
CID 175249037
1-triethoxysilylheptan-2-amine
CID 90410833
1,3-bis(triethoxysilyl)propan-1-amine
CID 154111466
1-triethoxysilylnonan-3-amine
CID 174893376
N,N-dimethyl-1-triethoxysilylhexan-1-amine
CID 89262216
1-[dimethoxy(methyl)silyl]heptan-1-amine
CID 174514624
1-[diethoxy(methyl)silyl]oxyoctan-2-amine
CID 151891449
2-triethoxysilyldodecanal
CID 162716787
triethoxy-[1-(1-triethoxysilyldodecylheptasulfanyl)dodecyl]silane
CID 54431230
(2S)-nonadecan-2-amine
CID 94864909

Frequently Asked Questions

What is the IUPAC name of 1-triethoxysilyldecan-1-amine?
The IUPAC name of 1-triethoxysilyldecan-1-amine (CID 87463354) is 1-triethoxysilyldecan-1-amine.
What is the SMILES notation for 1-triethoxysilyldecan-1-amine?
The canonical SMILES for 1-triethoxysilyldecan-1-amine is CCCCCCCCCC(N)[Si](OCC)(OCC)OCC.
What is the InChIKey of 1-triethoxysilyldecan-1-amine?
The InChIKey is BVHYFNKJTKOLAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H37NO3Si/c1-5-9-10-11-12-13-14-15-16(17)21(18-6-2,19-7-3)20-8-4/h16H,5-15,17H2,1-4H3.
What are the key properties of 1-triethoxysilyldecan-1-amine?
1-triethoxysilyldecan-1-amine has a molecular weight of 319.56 g/mol, XLogP of 4.04, 15 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-triethoxysilyldecan-1-amine is sourced from PubChem (CID 87463354), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).