[3-(benzylamino)prop-1-enyl-dimethylsilyl]methanol

C13H21NOSi — CID 140795783

IUPAC[3-(benzylamino)prop-1-enyl-dimethylsilyl]methanol
SMILESC[Si](C)(C=CCNCc1ccccc1)CO
InChIInChI=1S/C13H21NOSi/c1-16(2,12-15)10-6-9-14-11-13-7-4-3-5-8-13/h3-8,10,14-15H,9,11-12H2,1-2H3
InChIKeyFYYZMBKNBMGQKU-UHFFFAOYSA-N
MW235.40 g/mol
LogP2.11
Rot. Bonds6

About [3-(benzylamino)prop-1-enyl-dimethylsilyl]methanol

[3-(benzylamino)prop-1-enyl-dimethylsilyl]methanol (PubChem CID 140795783) has the molecular formula C13H21NOSi and a molecular weight of 235.40 g/mol. Its IUPAC name is [3-(benzylamino)prop-1-enyl-dimethylsilyl]methanol.

Molecular Properties

Compound Name[3-(benzylamino)prop-1-enyl-dimethylsilyl]methanol
PubChem CID140795783
Molecular FormulaC13H21NOSi
Molecular Weight235.40 g/mol
Exact Mass235.14
IUPAC Name[3-(benzylamino)prop-1-enyl-dimethylsilyl]methanol
SMILESC[Si](C)(C=CCNCc1ccccc1)CO
InChIInChI=1S/C13H21NOSi/c1-16(2,12-15)10-6-9-14-11-13-7-4-3-5-8-13/h3-8,10,14-15H,9,11-12H2,1-2H3
InChIKeyFYYZMBKNBMGQKU-UHFFFAOYSA-N
XLogP2.11
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.40
LogP ≤ 52.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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 [3-(benzylamino)prop-1-enyl-dimethylsilyl]methanol?
The IUPAC name of [3-(benzylamino)prop-1-enyl-dimethylsilyl]methanol (CID 140795783) is [3-(benzylamino)prop-1-enyl-dimethylsilyl]methanol.
What is the SMILES notation for [3-(benzylamino)prop-1-enyl-dimethylsilyl]methanol?
The canonical SMILES for [3-(benzylamino)prop-1-enyl-dimethylsilyl]methanol is C[Si](C)(C=CCNCc1ccccc1)CO.
What is the InChIKey of [3-(benzylamino)prop-1-enyl-dimethylsilyl]methanol?
The InChIKey is FYYZMBKNBMGQKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21NOSi/c1-16(2,12-15)10-6-9-14-11-13-7-4-3-5-8-13/h3-8,10,14-15H,9,11-12H2,1-2H3.
What are the key properties of [3-(benzylamino)prop-1-enyl-dimethylsilyl]methanol?
[3-(benzylamino)prop-1-enyl-dimethylsilyl]methanol has a molecular weight of 235.40 g/mol, XLogP of 2.11, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(benzylamino)prop-1-enyl-dimethylsilyl]methanol is sourced from PubChem (CID 140795783), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).