N-[3-[diethoxy(methyl)silyl]propyl]-1-phenylmethanimine;N-methylmethanamine

C17H32N2O2Si — CID 22491514

IUPACN-[3-[diethoxy(methyl)silyl]propyl]-1-phenylmethanimine;N-methylmethanamine
SMILESCCO[Si](C)(CCC/N=C/c1ccccc1)OCC.CNC
InChIInChI=1S/C15H25NO2Si.C2H7N/c1-4-17-19(3,18-5-2)13-9-12-16-14-15-10-7-6-8-11-15;1-3-2/h6-8,10-11,14H,4-5,9,12-13H2,1-3H3;3H,1-2H3/b16-14+;
InChIKeyPRFGCCJNCBCRRS-BACBYAOASA-N
MW324.54 g/mol
LogP3.48
Rot. Bonds9

About N-[3-[diethoxy(methyl)silyl]propyl]-1-phenylmethanimine;N-methylmethanamine

N-[3-[diethoxy(methyl)silyl]propyl]-1-phenylmethanimine;N-methylmethanamine (PubChem CID 22491514) has the molecular formula C17H32N2O2Si and a molecular weight of 324.54 g/mol. Its IUPAC name is N-[3-[diethoxy(methyl)silyl]propyl]-1-phenylmethanimine;N-methylmethanamine.

Molecular Properties

Compound NameN-[3-[diethoxy(methyl)silyl]propyl]-1-phenylmethanimine;N-methylmethanamine
PubChem CID22491514
Molecular FormulaC17H32N2O2Si
Molecular Weight324.54 g/mol
Exact Mass324.22
IUPAC NameN-[3-[diethoxy(methyl)silyl]propyl]-1-phenylmethanimine;N-methylmethanamine
SMILESCCO[Si](C)(CCC/N=C/c1ccccc1)OCC.CNC
InChIInChI=1S/C15H25NO2Si.C2H7N/c1-4-17-19(3,18-5-2)13-9-12-16-14-15-10-7-6-8-11-15;1-3-2/h6-8,10-11,14H,4-5,9,12-13H2,1-3H3;3H,1-2H3/b16-14+;
InChIKeyPRFGCCJNCBCRRS-BACBYAOASA-N
XLogP3.48
TPSA42.85 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.54
LogP ≤ 53.48
H-Bond Donors ≤ 51
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': 'imine_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-[3-[diethoxy(methyl)silyl]propyl]-1-phenylmethanimine;N-methylmethanamine?
The IUPAC name of N-[3-[diethoxy(methyl)silyl]propyl]-1-phenylmethanimine;N-methylmethanamine (CID 22491514) is N-[3-[diethoxy(methyl)silyl]propyl]-1-phenylmethanimine;N-methylmethanamine.
What is the SMILES notation for N-[3-[diethoxy(methyl)silyl]propyl]-1-phenylmethanimine;N-methylmethanamine?
The canonical SMILES for N-[3-[diethoxy(methyl)silyl]propyl]-1-phenylmethanimine;N-methylmethanamine is CCO[Si](C)(CCC/N=C/c1ccccc1)OCC.CNC.
What is the InChIKey of N-[3-[diethoxy(methyl)silyl]propyl]-1-phenylmethanimine;N-methylmethanamine?
The InChIKey is PRFGCCJNCBCRRS-BACBYAOASA-N. The full InChI is InChI=1S/C15H25NO2Si.C2H7N/c1-4-17-19(3,18-5-2)13-9-12-16-14-15-10-7-6-8-11-15;1-3-2/h6-8,10-11,14H,4-5,9,12-13H2,1-3H3;3H,1-2H3/b16-14+;.
What are the key properties of N-[3-[diethoxy(methyl)silyl]propyl]-1-phenylmethanimine;N-methylmethanamine?
N-[3-[diethoxy(methyl)silyl]propyl]-1-phenylmethanimine;N-methylmethanamine has a molecular weight of 324.54 g/mol, XLogP of 3.48, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[diethoxy(methyl)silyl]propyl]-1-phenylmethanimine;N-methylmethanamine is sourced from PubChem (CID 22491514), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).