8-triphenylsilyldibenzofuran-2-carboximidamide;hydrochloride

C31H25ClN2OSi — CID 144895282

IUPAC8-triphenylsilyldibenzofuran-2-carboximidamide;hydrochloride
SMILESCl.[H]/N=C(\N)c1ccc2oc3ccc([Si](c4ccccc4)(c4ccccc4)c4ccccc4)cc3c2c1
InChIInChI=1S/C31H24N2OSi.ClH/c32-31(33)22-16-18-29-27(20-22)28-21-26(17-19-30(28)34-29)35(23-10-4-1-5-11-23,24-12-6-2-7-13-24)25-14-8-3-9-15-25;/h1-21H,(H3,32,33);1H
InChIKeyLXSNHHJYEQQMCT-UHFFFAOYSA-N
MW505.09 g/mol
LogP4.67
Rot. Bonds5

About 8-triphenylsilyldibenzofuran-2-carboximidamide;hydrochloride

8-triphenylsilyldibenzofuran-2-carboximidamide;hydrochloride (PubChem CID 144895282) has the molecular formula C31H25ClN2OSi and a molecular weight of 505.09 g/mol. Its IUPAC name is 8-triphenylsilyldibenzofuran-2-carboximidamide;hydrochloride.

Molecular Properties

Compound Name8-triphenylsilyldibenzofuran-2-carboximidamide;hydrochloride
PubChem CID144895282
Molecular FormulaC31H25ClN2OSi
Molecular Weight505.09 g/mol
Exact Mass504.14
IUPAC Name8-triphenylsilyldibenzofuran-2-carboximidamide;hydrochloride
SMILESCl.[H]/N=C(\N)c1ccc2oc3ccc([Si](c4ccccc4)(c4ccccc4)c4ccccc4)cc3c2c1
InChIInChI=1S/C31H24N2OSi.ClH/c32-31(33)22-16-18-29-27(20-22)28-21-26(17-19-30(28)34-29)35(23-10-4-1-5-11-23,24-12-6-2-7-13-24)25-14-8-3-9-15-25;/h1-21H,(H3,32,33);1H
InChIKeyLXSNHHJYEQQMCT-UHFFFAOYSA-N
XLogP4.67
TPSA63.01 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms36
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500505.09
LogP ≤ 54.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'triphenyl_methyl-silyl', 'substructure': 'N/A'}

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Related Compounds

dibenzofuran-2-carboximidamide;hydrochloride
CID 156828195
bis(furo[2,3-b][1]benzofuran-7-yl)-diphenylsilane
CID 153462929
dibenzofuran-2-yl(phenyl)methanimine
CID 167230325
dibenzofuran-2-yl-(3-phenylphenyl)methanimine
CID 167230437
bis(18-carbazol-9-yl-10,14-dioxapentacyclo[11.7.0.03,11.04,9.015,20]icosa-1,3(11),4(9),5,7,12,15(20),16,18-nonaen-6-yl)-diphenylsilane
CID 59147251
benzenecarboximidamide;sulfane
CID 172701796
ethane;4-phenylbenzenecarboximidamide
CID 91221015
4-(5-phenyl-1,2-oxazol-3-yl)benzenecarboximidamide;hydrochloride
CID 16658981
benzenecarboximidamide;hydron;chloride
CID 66824376
[4-[4-dibenzofuran-2-yl-6-(6-naphthalen-2-ylnaphthalen-2-yl)-1,3,5-triazin-2-yl]phenyl]-triphenylsilane
CID 166569951
2-[10-(5-carbamimidoyl-1-benzofuran-2-yl)decyl]-1-benzofuran-5-carboximidamide;dihydrochloride
CID 23655931
3-[5-(4-carbamimidoylphenyl)furan-2-yl]benzenecarboximidamide;dihydrochloride
CID 11153113

Frequently Asked Questions

What is the IUPAC name of 8-triphenylsilyldibenzofuran-2-carboximidamide;hydrochloride?
The IUPAC name of 8-triphenylsilyldibenzofuran-2-carboximidamide;hydrochloride (CID 144895282) is 8-triphenylsilyldibenzofuran-2-carboximidamide;hydrochloride.
What is the SMILES notation for 8-triphenylsilyldibenzofuran-2-carboximidamide;hydrochloride?
The canonical SMILES for 8-triphenylsilyldibenzofuran-2-carboximidamide;hydrochloride is Cl.[H]/N=C(\N)c1ccc2oc3ccc([Si](c4ccccc4)(c4ccccc4)c4ccccc4)cc3c2c1.
What is the InChIKey of 8-triphenylsilyldibenzofuran-2-carboximidamide;hydrochloride?
The InChIKey is LXSNHHJYEQQMCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H24N2OSi.ClH/c32-31(33)22-16-18-29-27(20-22)28-21-26(17-19-30(28)34-29)35(23-10-4-1-5-11-23,24-12-6-2-7-13-24)25-14-8-3-9-15-25;/h1-21H,(H3,32,33);1H.
What are the key properties of 8-triphenylsilyldibenzofuran-2-carboximidamide;hydrochloride?
8-triphenylsilyldibenzofuran-2-carboximidamide;hydrochloride has a molecular weight of 505.09 g/mol, XLogP of 4.67, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-triphenylsilyldibenzofuran-2-carboximidamide;hydrochloride is sourced from PubChem (CID 144895282), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).