N-[[(E)-but-2-en-2-yl]-[tert-butyl(dimethyl)silyl]-propylsilyl]ethanamine

C15H35NSi2 — CID 87571969

IUPACN-[[(E)-but-2-en-2-yl]-[tert-butyl(dimethyl)silyl]-propylsilyl]ethanamine
SMILESC/C=C(\C)[Si](CCC)(NCC)[Si](C)(C)C(C)(C)C
InChIInChI=1S/C15H35NSi2/c1-10-13-18(16-12-3,14(4)11-2)17(8,9)15(5,6)7/h11,16H,10,12-13H2,1-9H3/b14-11+
InChIKeyGQOVBGKNWACNQR-SDNWHVSQSA-N
MW285.62 g/mol
LogP5.04
Rot. Bonds6

About N-[[(E)-but-2-en-2-yl]-[tert-butyl(dimethyl)silyl]-propylsilyl]ethanamine

N-[[(E)-but-2-en-2-yl]-[tert-butyl(dimethyl)silyl]-propylsilyl]ethanamine (PubChem CID 87571969) has the molecular formula C15H35NSi2 and a molecular weight of 285.62 g/mol. Its IUPAC name is N-[[(E)-but-2-en-2-yl]-[tert-butyl(dimethyl)silyl]-propylsilyl]ethanamine.

Molecular Properties

Compound NameN-[[(E)-but-2-en-2-yl]-[tert-butyl(dimethyl)silyl]-propylsilyl]ethanamine
PubChem CID87571969
Molecular FormulaC15H35NSi2
Molecular Weight285.62 g/mol
Exact Mass285.23
IUPAC NameN-[[(E)-but-2-en-2-yl]-[tert-butyl(dimethyl)silyl]-propylsilyl]ethanamine
SMILESC/C=C(\C)[Si](CCC)(NCC)[Si](C)(C)C(C)(C)C
InChIInChI=1S/C15H35NSi2/c1-10-13-18(16-12-3,14(4)11-2)17(8,9)15(5,6)7/h11,16H,10,12-13H2,1-9H3/b14-11+
InChIKeyGQOVBGKNWACNQR-SDNWHVSQSA-N
XLogP5.04
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500285.62
LogP ≤ 55.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-[[(E)-but-2-en-2-yl]-[tert-butyl(dimethyl)silyl]-propylsilyl]ethanamine?
The IUPAC name of N-[[(E)-but-2-en-2-yl]-[tert-butyl(dimethyl)silyl]-propylsilyl]ethanamine (CID 87571969) is N-[[(E)-but-2-en-2-yl]-[tert-butyl(dimethyl)silyl]-propylsilyl]ethanamine.
What is the SMILES notation for N-[[(E)-but-2-en-2-yl]-[tert-butyl(dimethyl)silyl]-propylsilyl]ethanamine?
The canonical SMILES for N-[[(E)-but-2-en-2-yl]-[tert-butyl(dimethyl)silyl]-propylsilyl]ethanamine is C/C=C(\C)[Si](CCC)(NCC)[Si](C)(C)C(C)(C)C.
What is the InChIKey of N-[[(E)-but-2-en-2-yl]-[tert-butyl(dimethyl)silyl]-propylsilyl]ethanamine?
The InChIKey is GQOVBGKNWACNQR-SDNWHVSQSA-N. The full InChI is InChI=1S/C15H35NSi2/c1-10-13-18(16-12-3,14(4)11-2)17(8,9)15(5,6)7/h11,16H,10,12-13H2,1-9H3/b14-11+.
What are the key properties of N-[[(E)-but-2-en-2-yl]-[tert-butyl(dimethyl)silyl]-propylsilyl]ethanamine?
N-[[(E)-but-2-en-2-yl]-[tert-butyl(dimethyl)silyl]-propylsilyl]ethanamine has a molecular weight of 285.62 g/mol, XLogP of 5.04, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[(E)-but-2-en-2-yl]-[tert-butyl(dimethyl)silyl]-propylsilyl]ethanamine is sourced from PubChem (CID 87571969), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).