CID 90351841

C17H30N2Si+ — CID 90351841

IUPAC—
SMILESC[N+](C)(CCCCCNCCC[Si])Cc1ccccc1
InChIInChI=1S/C17H30N2Si/c1-19(2,16-17-10-5-3-6-11-17)14-8-4-7-12-18-13-9-15-20/h3,5-6,10-11,18H,4,7-9,12-16H2,1-2H3/q+1
InChIKeyHBCYXRQJQIDNLG-UHFFFAOYSA-N
MW290.53 g/mol
LogP3.00
Rot. Bonds11

About CID 90351841

CID 90351841 (PubChem CID 90351841) has the molecular formula C17H30N2Si+ and a molecular weight of 290.53 g/mol.

Molecular Properties

Compound NameCID 90351841
PubChem CID90351841
Molecular FormulaC17H30N2Si+
Molecular Weight290.53 g/mol
Exact Mass290.22
IUPAC Name—
SMILESC[N+](C)(CCCCCNCCC[Si])Cc1ccccc1
InChIInChI=1S/C17H30N2Si/c1-19(2,16-17-10-5-3-6-11-17)14-8-4-7-12-18-13-9-15-20/h3,5-6,10-11,18H,4,7-9,12-16H2,1-2H3/q+1
InChIKeyHBCYXRQJQIDNLG-UHFFFAOYSA-N
XLogP3.00
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds11
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.53
LogP ≤ 53.00
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'}, {'alert_name': 'quaternary_nitrogen_2', 'substructure': 'N/A'}

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Related Compounds

CID 155631863
CID 155631863
benzyl-dimethyl-[7-(3-silylpropylamino)heptyl]azanium
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benzyl-dimethyl-[5-(3-silylpropylamino)pentyl]azanium
CID 123692124
benzyl-dimethyl-[3-(octylamino)propyl]azanium
CID 139808252
benzyl-dimethyl-[4-(silylmethylamino)butyl]azanium
CID 123467353
benzyl-dimethyl-[3-(16-methylheptadecylamino)propyl]azanium chloride
CID 141345422
benzyl-dimethyl-octylazanium
CID 13741
benzyl-dimethyl-octadecylazanium;benzyl-hexadecyl-dimethylazanium
CID 159179523
benzyl-heptyl-dimethylazanium chloride
CID 23274918
tris(benzyl-dodecyl-dimethylazanium);tribromide
CID 155665719
benzyl-dodecyl-dimethylazanium bromide
CID 23705
benzyl-dimethyl-octylazanium;benzyl-dodecyl-dimethylazanium;difluoride
CID 162146991

Frequently Asked Questions

What is the IUPAC name of CID 90351841?
The IUPAC name of CID 90351841 (CID 90351841) is not available.
What is the SMILES notation for CID 90351841?
The canonical SMILES for CID 90351841 is C[N+](C)(CCCCCNCCC[Si])Cc1ccccc1.
What is the InChIKey of CID 90351841?
The InChIKey is HBCYXRQJQIDNLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H30N2Si/c1-19(2,16-17-10-5-3-6-11-17)14-8-4-7-12-18-13-9-15-20/h3,5-6,10-11,18H,4,7-9,12-16H2,1-2H3/q+1.
What are the key properties of CID 90351841?
CID 90351841 has a molecular weight of 290.53 g/mol, XLogP of 3.00, 11 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 90351841 is sourced from PubChem (CID 90351841), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).