CID 166047507

C19H44NO7Si3 — CID 166047507

IUPAC—
SMILESCCO[Si](CCCNC(=O)OCCOCCC[Si](C)O[Si](C)(C)C)(OCC)OCC
InChIInChI=1S/C19H44NO7Si3/c1-8-24-30(25-9-2,26-10-3)18-11-13-20-19(21)23-16-15-22-14-12-17-28(4)27-29(5,6)7/h8-18H2,1-7H3,(H,20,21)
InChIKeyJQBRPGIWBOIRGD-UHFFFAOYSA-N
MW482.82 g/mol
LogP4.03
Rot. Bonds19

About CID 166047507

CID 166047507 (PubChem CID 166047507) has the molecular formula C19H44NO7Si3 and a molecular weight of 482.82 g/mol.

Molecular Properties

Compound NameCID 166047507
PubChem CID166047507
Molecular FormulaC19H44NO7Si3
Molecular Weight482.82 g/mol
Exact Mass482.24
IUPAC Name—
SMILESCCO[Si](CCCNC(=O)OCCOCCC[Si](C)O[Si](C)(C)C)(OCC)OCC
InChIInChI=1S/C19H44NO7Si3/c1-8-24-30(25-9-2,26-10-3)18-11-13-20-19(21)23-16-15-22-14-12-17-28(4)27-29(5,6)7/h8-18H2,1-7H3,(H,20,21)
InChIKeyJQBRPGIWBOIRGD-UHFFFAOYSA-N
XLogP4.03
TPSA84.48 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds19
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500482.82
LogP ≤ 54.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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

2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethyl N-(3-triethoxysilylpropyl)carbamate
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2-[2-(3-triethoxysilylpropoxycarbonylamino)ethoxy]ethyl 2-methylprop-2-enoate
CID 152545568
[3-oxo-3-(3-triethoxysilylpropylamino)propyl] N-(3-triethoxysilylpropyl)carbamate
CID 123219063
octadecyl N-(3-triethoxysilylpropyl)carbamate
CID 58802948
heptadecyl N-(3-triethoxysilylpropyl)carbamate
CID 102190904
but-3-ynyl N-(3-triethoxysilylpropyl)carbamate
CID 71441394
6-(3-triethoxysilylpropylcarbamoyloxy)hexanoic acid
CID 58205270
CID 102321543
CID 102321543
2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]-N-(3-triethoxysilylpropyl)acetamide
CID 71617959
2-[2,2-bis[2-(3-trimethoxysilylpropylcarbamoyloxy)ethoxymethyl]butoxy]ethyl N-(3-trimethoxysilylpropyl)carbamate
CID 168787203
[3-(difluoroamino)-2,2,3,3-tetrafluoropropyl] N-(3-triethoxysilylpropyl)carbamate
CID 140787363
[3-(butan-2-ylamino)-3-oxopropyl] N-(3-triethoxysilylpropyl)carbamate
CID 59582714

Frequently Asked Questions

What is the IUPAC name of CID 166047507?
The IUPAC name of CID 166047507 (CID 166047507) is not available.
What is the SMILES notation for CID 166047507?
The canonical SMILES for CID 166047507 is CCO[Si](CCCNC(=O)OCCOCCC[Si](C)O[Si](C)(C)C)(OCC)OCC.
What is the InChIKey of CID 166047507?
The InChIKey is JQBRPGIWBOIRGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H44NO7Si3/c1-8-24-30(25-9-2,26-10-3)18-11-13-20-19(21)23-16-15-22-14-12-17-28(4)27-29(5,6)7/h8-18H2,1-7H3,(H,20,21).
What are the key properties of CID 166047507?
CID 166047507 has a molecular weight of 482.82 g/mol, XLogP of 4.03, 19 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for CID 166047507 is sourced from PubChem (CID 166047507), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).