bis(bis(trimethylsilyl)azanide);bis(pyrrol-1-id-2-ylmethyl-(2,4,6-trimethylphenyl)azanide);bis(samarium(3+))

C40H68N6Si4Sm2 — CID 139162003

IUPACbis(bis(trimethylsilyl)azanide);bis(pyrrol-1-id-2-ylmethyl-(2,4,6-trimethylphenyl)azanide);bis(samarium(3+))
SMILESC[Si](C)(C)[N-][Si](C)(C)C.C[Si](C)(C)[N-][Si](C)(C)C.Cc1cc(C)c([N-]Cc2ccc[n-]2)c(C)c1.Cc1cc(C)c([N-]Cc2ccc[n-]2)c(C)c1.[Sm+3].[Sm+3]
InChIInChI=1S/2C14H16N2.2C6H18NSi2.2Sm/c2*1-10-7-11(2)14(12(3)8-10)16-9-13-5-4-6-15-13;2*1-8(2,3)7-9(4,5)6;;/h2*4-8H,9H2,1-3H3;2*1-6H3;;/q2*-2;2*-1;2*+3
InChIKeyUDTYSARJPIGKOS-UHFFFAOYSA-N
MW1046.09 g/mol
LogP13.61
Rot. Bonds10

About bis(bis(trimethylsilyl)azanide);bis(pyrrol-1-id-2-ylmethyl-(2,4,6-trimethylphenyl)azanide);bis(samarium(3+))

bis(bis(trimethylsilyl)azanide);bis(pyrrol-1-id-2-ylmethyl-(2,4,6-trimethylphenyl)azanide);bis(samarium(3+)) (PubChem CID 139162003) has the molecular formula C40H68N6Si4Sm2 and a molecular weight of 1046.09 g/mol. Its IUPAC name is bis(bis(trimethylsilyl)azanide);bis(pyrrol-1-id-2-ylmethyl-(2,4,6-trimethylphenyl)azanide);bis(samarium(3+)).

Molecular Properties

Compound Namebis(bis(trimethylsilyl)azanide);bis(pyrrol-1-id-2-ylmethyl-(2,4,6-trimethylphenyl)azanide);bis(samarium(3+))
PubChem CID139162003
Molecular FormulaC40H68N6Si4Sm2
Molecular Weight1046.09 g/mol
Exact Mass1048.30
IUPAC Namebis(bis(trimethylsilyl)azanide);bis(pyrrol-1-id-2-ylmethyl-(2,4,6-trimethylphenyl)azanide);bis(samarium(3+))
SMILESC[Si](C)(C)[N-][Si](C)(C)C.C[Si](C)(C)[N-][Si](C)(C)C.Cc1cc(C)c([N-]Cc2ccc[n-]2)c(C)c1.Cc1cc(C)c([N-]Cc2ccc[n-]2)c(C)c1.[Sm+3].[Sm+3]
InChIInChI=1S/2C14H16N2.2C6H18NSi2.2Sm/c2*1-10-7-11(2)14(12(3)8-10)16-9-13-5-4-6-15-13;2*1-8(2,3)7-9(4,5)6;;/h2*4-8H,9H2,1-3H3;2*1-6H3;;/q2*-2;2*-1;2*+3
InChIKeyUDTYSARJPIGKOS-UHFFFAOYSA-N
XLogP13.61
TPSA84.60 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds10
Heavy Atoms52
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001046.09
LogP ≤ 513.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

lithium (2,4,6-trimethylphenyl)-trimethylsilylazanide
CID 12699524
ethane;propyl-(2,4,6-trimethylphenyl)azanide;zirconium
CID 58594809
zinc;tris(bis(trimethylsilyl)azanide);rubidium(1+);toluene
CID 139106442
magnesium;potassium;tris(bis(trimethylsilyl)azanide);toluene
CID 139106439
dichlorotitanium;(2,4,6-trimethylphenyl)-[2-[2-(2,4,6-trimethylphenyl)azanidylethyl-trimethylsilylamino]ethyl]azanide
CID 11635085
lithium [2,6-bis(2,4,6-trimethylphenyl)phenyl]-trimethylsilylazanide
CID 101398380
dichlorotitanium;2-[2-(9H-fluoren-9-yl)phenyl]propan-2-yl-(2,4,6-trimethylphenyl)azanide
CID 173093966
(2,3,4,5,6-pentamethylphenyl)-[2-[2-(2,4,6-trimethylphenyl)azanidylethylamino]ethyl]azanide;phenylmethanone;zirconium
CID 153430758
bis((2,6-dimethylphenyl)-(2-methanidylphenyl)azanide);ethane;bis(propyl-(2,4,6-trimethylphenyl)azanide);zirconium
CID 158363093
[2-(2-methyl-1H-inden-1-yl)naphthalen-1-yl]methyl-(2,4,6-trimethylphenyl)azanide;titanium
CID 87586888
[2-(2-methyl-1H-inden-1-yl)naphthalen-1-yl]methyl-(2,4,6-trimethylphenyl)azanide;titanium(3+);dichloride
CID 87500510
[2-(2-methylcyclopenta-1,3-dien-1-yl)naphthalen-1-yl]methyl-(2,4,6-trimethylphenyl)azanide;titanium(3+);dichloride
CID 87501338

Frequently Asked Questions

What is the IUPAC name of bis(bis(trimethylsilyl)azanide);bis(pyrrol-1-id-2-ylmethyl-(2,4,6-trimethylphenyl)azanide);bis(samarium(3+))?
The IUPAC name of bis(bis(trimethylsilyl)azanide);bis(pyrrol-1-id-2-ylmethyl-(2,4,6-trimethylphenyl)azanide);bis(samarium(3+)) (CID 139162003) is bis(bis(trimethylsilyl)azanide);bis(pyrrol-1-id-2-ylmethyl-(2,4,6-trimethylphenyl)azanide);bis(samarium(3+)).
What is the SMILES notation for bis(bis(trimethylsilyl)azanide);bis(pyrrol-1-id-2-ylmethyl-(2,4,6-trimethylphenyl)azanide);bis(samarium(3+))?
The canonical SMILES for bis(bis(trimethylsilyl)azanide);bis(pyrrol-1-id-2-ylmethyl-(2,4,6-trimethylphenyl)azanide);bis(samarium(3+)) is C[Si](C)(C)[N-][Si](C)(C)C.C[Si](C)(C)[N-][Si](C)(C)C.Cc1cc(C)c([N-]Cc2ccc[n-]2)c(C)c1.Cc1cc(C)c([N-]Cc2ccc[n-]2)c(C)c1.[Sm+3].[Sm+3].
What is the InChIKey of bis(bis(trimethylsilyl)azanide);bis(pyrrol-1-id-2-ylmethyl-(2,4,6-trimethylphenyl)azanide);bis(samarium(3+))?
The InChIKey is UDTYSARJPIGKOS-UHFFFAOYSA-N. The full InChI is InChI=1S/2C14H16N2.2C6H18NSi2.2Sm/c2*1-10-7-11(2)14(12(3)8-10)16-9-13-5-4-6-15-13;2*1-8(2,3)7-9(4,5)6;;/h2*4-8H,9H2,1-3H3;2*1-6H3;;/q2*-2;2*-1;2*+3.
What are the key properties of bis(bis(trimethylsilyl)azanide);bis(pyrrol-1-id-2-ylmethyl-(2,4,6-trimethylphenyl)azanide);bis(samarium(3+))?
bis(bis(trimethylsilyl)azanide);bis(pyrrol-1-id-2-ylmethyl-(2,4,6-trimethylphenyl)azanide);bis(samarium(3+)) has a molecular weight of 1046.09 g/mol, XLogP of 13.61, 10 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for bis(bis(trimethylsilyl)azanide);bis(pyrrol-1-id-2-ylmethyl-(2,4,6-trimethylphenyl)azanide);bis(samarium(3+)) is sourced from PubChem (CID 139162003), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).