6-[ethoxy(diethyl)silyl]-1-triethoxysilylhexan-3-amine

C18H43NO4Si2 — CID 87296354

IUPAC6-[ethoxy(diethyl)silyl]-1-triethoxysilylhexan-3-amine
SMILESCCO[Si](CC)(CC)CCCC(N)CC[Si](OCC)(OCC)OCC
InChIInChI=1S/C18H43NO4Si2/c1-7-20-24(11-5,12-6)16-13-14-18(19)15-17-25(21-8-2,22-9-3)23-10-4/h18H,7-17,19H2,1-6H3
InChIKeyFNRYYAPMFYDXRU-UHFFFAOYSA-N
MW393.72 g/mol
LogP4.55
Rot. Bonds17

About 6-[ethoxy(diethyl)silyl]-1-triethoxysilylhexan-3-amine

6-[ethoxy(diethyl)silyl]-1-triethoxysilylhexan-3-amine (PubChem CID 87296354) has the molecular formula C18H43NO4Si2 and a molecular weight of 393.72 g/mol. Its IUPAC name is 6-[ethoxy(diethyl)silyl]-1-triethoxysilylhexan-3-amine.

Molecular Properties

Compound Name6-[ethoxy(diethyl)silyl]-1-triethoxysilylhexan-3-amine
PubChem CID87296354
Molecular FormulaC18H43NO4Si2
Molecular Weight393.72 g/mol
Exact Mass393.27
IUPAC Name6-[ethoxy(diethyl)silyl]-1-triethoxysilylhexan-3-amine
SMILESCCO[Si](CC)(CC)CCCC(N)CC[Si](OCC)(OCC)OCC
InChIInChI=1S/C18H43NO4Si2/c1-7-20-24(11-5,12-6)16-13-14-18(19)15-17-25(21-8-2,22-9-3)23-10-4/h18H,7-17,19H2,1-6H3
InChIKeyFNRYYAPMFYDXRU-UHFFFAOYSA-N
XLogP4.55
TPSA62.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds17
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500393.72
LogP ≤ 54.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

1-triethoxysilylnonan-3-amine
CID 174893376
triethoxy-[6-[ethoxy(diethyl)silyl]hexyl]silane
CID 123350004
triethoxy-[3-[ethoxy(diethyl)silyl]propyl]silane
CID 87307259
1,3-bis(triethoxysilyl)propan-1-amine
CID 154111466
triethoxy(10-triethoxysilyldecyl)silane
CID 14439044
2-[ethoxy(diethyl)silyl]ethanamine
CID 87732470
1-triethoxysilylheptan-2-amine
CID 90410833
1,5-bis(trimethoxysilyl)pentan-3-amine
CID 87668176
36-triethoxysilylhexatriacontan-1-amine
CID 87683625
5-triethoxysilylpentane-2-thiol
CID 19834372
12-triethoxysilyldodecan-1-amine;hydrochloride
CID 175579282
triethoxy-[[4-triethoxysilyl-1-(triethoxysilylmethoxy)butoxy]methyl]silane
CID 165129410

Frequently Asked Questions

What is the IUPAC name of 6-[ethoxy(diethyl)silyl]-1-triethoxysilylhexan-3-amine?
The IUPAC name of 6-[ethoxy(diethyl)silyl]-1-triethoxysilylhexan-3-amine (CID 87296354) is 6-[ethoxy(diethyl)silyl]-1-triethoxysilylhexan-3-amine.
What is the SMILES notation for 6-[ethoxy(diethyl)silyl]-1-triethoxysilylhexan-3-amine?
The canonical SMILES for 6-[ethoxy(diethyl)silyl]-1-triethoxysilylhexan-3-amine is CCO[Si](CC)(CC)CCCC(N)CC[Si](OCC)(OCC)OCC.
What is the InChIKey of 6-[ethoxy(diethyl)silyl]-1-triethoxysilylhexan-3-amine?
The InChIKey is FNRYYAPMFYDXRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H43NO4Si2/c1-7-20-24(11-5,12-6)16-13-14-18(19)15-17-25(21-8-2,22-9-3)23-10-4/h18H,7-17,19H2,1-6H3.
What are the key properties of 6-[ethoxy(diethyl)silyl]-1-triethoxysilylhexan-3-amine?
6-[ethoxy(diethyl)silyl]-1-triethoxysilylhexan-3-amine has a molecular weight of 393.72 g/mol, XLogP of 4.55, 17 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[ethoxy(diethyl)silyl]-1-triethoxysilylhexan-3-amine is sourced from PubChem (CID 87296354), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).