CID 102321543

C15H35N2O4Si2 — CID 102321543

IUPAC—
SMILESCCO[Si](CCCNC(=O)NCCC[Si](C)C)(OCC)OCC
InChIInChI=1S/C15H35N2O4Si2/c1-6-19-23(20-7-2,21-8-3)14-10-12-17-15(18)16-11-9-13-22(4)5/h6-14H2,1-5H3,(H2,16,17,18)
InChIKeyPXPLBEVGSZXRPP-UHFFFAOYSA-N
MW363.63 g/mol
LogP2.87
Rot. Bonds14

About CID 102321543

CID 102321543 (PubChem CID 102321543) has the molecular formula C15H35N2O4Si2 and a molecular weight of 363.63 g/mol.

Molecular Properties

Compound NameCID 102321543
PubChem CID102321543
Molecular FormulaC15H35N2O4Si2
Molecular Weight363.63 g/mol
Exact Mass363.21
IUPAC Name—
SMILESCCO[Si](CCCNC(=O)NCCC[Si](C)C)(OCC)OCC
InChIInChI=1S/C15H35N2O4Si2/c1-6-19-23(20-7-2,21-8-3)14-10-12-17-15(18)16-11-9-13-22(4)5/h6-14H2,1-5H3,(H2,16,17,18)
InChIKeyPXPLBEVGSZXRPP-UHFFFAOYSA-N
XLogP2.87
TPSA68.82 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds14
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.63
LogP ≤ 52.87
H-Bond Donors ≤ 52
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-(3-triethoxysilylpropyl)-3-[6-(3-triethoxysilylpropylcarbamoylamino)hexyl]urea
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CID 102048521
1-(3-triethoxysilylpropyl)-3-[(3-triethoxysilylpropylcarbamoylamino)carbamothioylamino]urea
CID 102174342
1-(3-triethoxysilylpropyl)-3-[6-[2,4,6-trioxo-3,5-bis[6-(3-triethoxysilylpropylcarbamoylamino)hexyl]-1,3,5-triazinan-1-yl]hexyl]urea
CID 100991329
silane;3-triethoxysilylpropylurea
CID 161180470
2-amino-N-(3-triethoxysilylpropyl)acetamide
CID 59561209
N-(3-triethoxysilylpropyl)butanamide
CID 20829613
1-butyl-3-(8-oxo-12-triethoxysilyldodecyl)urea
CID 58571374
3-triethoxysilylpropan-1-amine;3-triethoxysilylpropylurea
CID 88634615
1-(2-morpholin-4-ylethyl)-3-(3-triethoxysilylpropyl)urea
CID 59782824
1,3-bis(4-tripropoxysilylbutyl)urea
CID 170548769
prop-2-ynyl N-(3-triethoxysilylpropyl)carbamate;1-prop-2-ynyl-3-(3-triethoxysilylpropyl)urea
CID 158429621

Frequently Asked Questions

What is the IUPAC name of CID 102321543?
The IUPAC name of CID 102321543 (CID 102321543) is not available.
What is the SMILES notation for CID 102321543?
The canonical SMILES for CID 102321543 is CCO[Si](CCCNC(=O)NCCC[Si](C)C)(OCC)OCC.
What is the InChIKey of CID 102321543?
The InChIKey is PXPLBEVGSZXRPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H35N2O4Si2/c1-6-19-23(20-7-2,21-8-3)14-10-12-17-15(18)16-11-9-13-22(4)5/h6-14H2,1-5H3,(H2,16,17,18).
What are the key properties of CID 102321543?
CID 102321543 has a molecular weight of 363.63 g/mol, XLogP of 2.87, 14 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for CID 102321543 is sourced from PubChem (CID 102321543), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).