[dimethyl(octadecyl)silyl]methanamine

C21H47NSi — CID 87605582

IUPAC[dimethyl(octadecyl)silyl]methanamine
SMILESCCCCCCCCCCCCCCCCCC[Si](C)(C)CN
InChIInChI=1S/C21H47NSi/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-23(2,3)21-22/h4-22H2,1-3H3
InChIKeyAWGOVSHWUMSEBQ-UHFFFAOYSA-N
MW341.70 g/mol
LogP7.45
Rot. Bonds18

About [dimethyl(octadecyl)silyl]methanamine

[dimethyl(octadecyl)silyl]methanamine (PubChem CID 87605582) has the molecular formula C21H47NSi and a molecular weight of 341.70 g/mol. Its IUPAC name is [dimethyl(octadecyl)silyl]methanamine.

Molecular Properties

Compound Name[dimethyl(octadecyl)silyl]methanamine
PubChem CID87605582
Molecular FormulaC21H47NSi
Molecular Weight341.70 g/mol
Exact Mass341.35
IUPAC Name[dimethyl(octadecyl)silyl]methanamine
SMILESCCCCCCCCCCCCCCCCCC[Si](C)(C)CN
InChIInChI=1S/C21H47NSi/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-23(2,3)21-22/h4-22H2,1-3H3
InChIKeyAWGOVSHWUMSEBQ-UHFFFAOYSA-N
XLogP7.45
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds18
Heavy Atoms23
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500341.70
LogP ≤ 57.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [dimethyl(octadecyl)silyl]methanamine?
The IUPAC name of [dimethyl(octadecyl)silyl]methanamine (CID 87605582) is [dimethyl(octadecyl)silyl]methanamine.
What is the SMILES notation for [dimethyl(octadecyl)silyl]methanamine?
The canonical SMILES for [dimethyl(octadecyl)silyl]methanamine is CCCCCCCCCCCCCCCCCC[Si](C)(C)CN.
What is the InChIKey of [dimethyl(octadecyl)silyl]methanamine?
The InChIKey is AWGOVSHWUMSEBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H47NSi/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-23(2,3)21-22/h4-22H2,1-3H3.
What are the key properties of [dimethyl(octadecyl)silyl]methanamine?
[dimethyl(octadecyl)silyl]methanamine has a molecular weight of 341.70 g/mol, XLogP of 7.45, 18 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [dimethyl(octadecyl)silyl]methanamine is sourced from PubChem (CID 87605582), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).