1-(3-dimethoxysilylpropyl)-2-octadecylhydrazine;hydrochloride

C23H53ClN2O2Si — CID 173327616

IUPAC1-(3-dimethoxysilylpropyl)-2-octadecylhydrazine;hydrochloride
SMILESCCCCCCCCCCCCCCCCCCNNCCC[SiH](OC)OC.Cl
InChIInChI=1S/C23H52N2O2Si.ClH/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-21-24-25-22-20-23-28(26-2)27-3;/h24-25,28H,4-23H2,1-3H3;1H
InChIKeySZWLMXWBBPEGOK-UHFFFAOYSA-N
MW453.23 g/mol
LogP6.67
Rot. Bonds24

About 1-(3-dimethoxysilylpropyl)-2-octadecylhydrazine;hydrochloride

1-(3-dimethoxysilylpropyl)-2-octadecylhydrazine;hydrochloride (PubChem CID 173327616) has the molecular formula C23H53ClN2O2Si and a molecular weight of 453.23 g/mol. Its IUPAC name is 1-(3-dimethoxysilylpropyl)-2-octadecylhydrazine;hydrochloride.

Molecular Properties

Compound Name1-(3-dimethoxysilylpropyl)-2-octadecylhydrazine;hydrochloride
PubChem CID173327616
Molecular FormulaC23H53ClN2O2Si
Molecular Weight453.23 g/mol
Exact Mass452.36
IUPAC Name1-(3-dimethoxysilylpropyl)-2-octadecylhydrazine;hydrochloride
SMILESCCCCCCCCCCCCCCCCCCNNCCC[SiH](OC)OC.Cl
InChIInChI=1S/C23H52N2O2Si.ClH/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-21-24-25-22-20-23-28(26-2)27-3;/h24-25,28H,4-23H2,1-3H3;1H
InChIKeySZWLMXWBBPEGOK-UHFFFAOYSA-N
XLogP6.67
TPSA42.52 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds24
Heavy Atoms29
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500453.23
LogP ≤ 56.67
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'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-(3-dimethoxysilylpropyl)-2-octadecylhydrazine;hydrochloride?
The IUPAC name of 1-(3-dimethoxysilylpropyl)-2-octadecylhydrazine;hydrochloride (CID 173327616) is 1-(3-dimethoxysilylpropyl)-2-octadecylhydrazine;hydrochloride.
What is the SMILES notation for 1-(3-dimethoxysilylpropyl)-2-octadecylhydrazine;hydrochloride?
The canonical SMILES for 1-(3-dimethoxysilylpropyl)-2-octadecylhydrazine;hydrochloride is CCCCCCCCCCCCCCCCCCNNCCC[SiH](OC)OC.Cl.
What is the InChIKey of 1-(3-dimethoxysilylpropyl)-2-octadecylhydrazine;hydrochloride?
The InChIKey is SZWLMXWBBPEGOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H52N2O2Si.ClH/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-21-24-25-22-20-23-28(26-2)27-3;/h24-25,28H,4-23H2,1-3H3;1H.
What are the key properties of 1-(3-dimethoxysilylpropyl)-2-octadecylhydrazine;hydrochloride?
1-(3-dimethoxysilylpropyl)-2-octadecylhydrazine;hydrochloride has a molecular weight of 453.23 g/mol, XLogP of 6.67, 24 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-dimethoxysilylpropyl)-2-octadecylhydrazine;hydrochloride is sourced from PubChem (CID 173327616), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).