tetrakis(propan-2-yl-[N'-propan-2-yl-N,N-bis(trimethylsilyl)carbamimidoyl]azanide);bis(yttrium)

C52H128N12Si8Y2-4 — CID 11845690

IUPACtetrakis(propan-2-yl-[N'-propan-2-yl-N,N-bis(trimethylsilyl)carbamimidoyl]azanide);bis(yttrium)
SMILESCC(C)/N=C(\[N-]C(C)C)N([Si](C)(C)C)[Si](C)(C)C.CC(C)/N=C(\[N-]C(C)C)N([Si](C)(C)C)[Si](C)(C)C.CC(C)/N=C(\[N-]C(C)C)N([Si](C)(C)C)[Si](C)(C)C.CC(C)/N=C(\[N-]C(C)C)N([Si](C)(C)C)[Si](C)(C)C.[Y].[Y]
InChIInChI=1S/4C13H32N3Si2.2Y/c4*1-11(2)14-13(15-12(3)4)16(17(5,6)7)18(8,9)10;;/h4*11-12H,1-10H3;;/q4*-1;;
InChIKeyJQGTVSSBFJAWJI-UHFFFAOYSA-N
MW1324.18 g/mol
LogP18.01
Rot. Bonds16

About tetrakis(propan-2-yl-[N'-propan-2-yl-N,N-bis(trimethylsilyl)carbamimidoyl]azanide);bis(yttrium)

tetrakis(propan-2-yl-[N'-propan-2-yl-N,N-bis(trimethylsilyl)carbamimidoyl]azanide);bis(yttrium) (PubChem CID 11845690) has the molecular formula C52H128N12Si8Y2-4 and a molecular weight of 1324.18 g/mol. Its IUPAC name is tetrakis(propan-2-yl-[N'-propan-2-yl-N,N-bis(trimethylsilyl)carbamimidoyl]azanide);bis(yttrium).

Molecular Properties

Compound Nametetrakis(propan-2-yl-[N'-propan-2-yl-N,N-bis(trimethylsilyl)carbamimidoyl]azanide);bis(yttrium)
PubChem CID11845690
Molecular FormulaC52H128N12Si8Y2-4
Molecular Weight1324.18 g/mol
Exact Mass1322.67
IUPAC Nametetrakis(propan-2-yl-[N'-propan-2-yl-N,N-bis(trimethylsilyl)carbamimidoyl]azanide);bis(yttrium)
SMILESCC(C)/N=C(\[N-]C(C)C)N([Si](C)(C)C)[Si](C)(C)C.CC(C)/N=C(\[N-]C(C)C)N([Si](C)(C)C)[Si](C)(C)C.CC(C)/N=C(\[N-]C(C)C)N([Si](C)(C)C)[Si](C)(C)C.CC(C)/N=C(\[N-]C(C)C)N([Si](C)(C)C)[Si](C)(C)C.[Y].[Y]
InChIInChI=1S/4C13H32N3Si2.2Y/c4*1-11(2)14-13(15-12(3)4)16(17(5,6)7)18(8,9)10;;/h4*11-12H,1-10H3;;/q4*-1;;
InChIKeyJQGTVSSBFJAWJI-UHFFFAOYSA-N
XLogP18.01
TPSA118.80 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds16
Heavy Atoms74
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001324.18
LogP ≤ 518.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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'}

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Frequently Asked Questions

What is the IUPAC name of tetrakis(propan-2-yl-[N'-propan-2-yl-N,N-bis(trimethylsilyl)carbamimidoyl]azanide);bis(yttrium)?
The IUPAC name of tetrakis(propan-2-yl-[N'-propan-2-yl-N,N-bis(trimethylsilyl)carbamimidoyl]azanide);bis(yttrium) (CID 11845690) is tetrakis(propan-2-yl-[N'-propan-2-yl-N,N-bis(trimethylsilyl)carbamimidoyl]azanide);bis(yttrium).
What is the SMILES notation for tetrakis(propan-2-yl-[N'-propan-2-yl-N,N-bis(trimethylsilyl)carbamimidoyl]azanide);bis(yttrium)?
The canonical SMILES for tetrakis(propan-2-yl-[N'-propan-2-yl-N,N-bis(trimethylsilyl)carbamimidoyl]azanide);bis(yttrium) is CC(C)/N=C(\[N-]C(C)C)N([Si](C)(C)C)[Si](C)(C)C.CC(C)/N=C(\[N-]C(C)C)N([Si](C)(C)C)[Si](C)(C)C.CC(C)/N=C(\[N-]C(C)C)N([Si](C)(C)C)[Si](C)(C)C.CC(C)/N=C(\[N-]C(C)C)N([Si](C)(C)C)[Si](C)(C)C.[Y].[Y].
What is the InChIKey of tetrakis(propan-2-yl-[N'-propan-2-yl-N,N-bis(trimethylsilyl)carbamimidoyl]azanide);bis(yttrium)?
The InChIKey is JQGTVSSBFJAWJI-UHFFFAOYSA-N. The full InChI is InChI=1S/4C13H32N3Si2.2Y/c4*1-11(2)14-13(15-12(3)4)16(17(5,6)7)18(8,9)10;;/h4*11-12H,1-10H3;;/q4*-1;;.
What are the key properties of tetrakis(propan-2-yl-[N'-propan-2-yl-N,N-bis(trimethylsilyl)carbamimidoyl]azanide);bis(yttrium)?
tetrakis(propan-2-yl-[N'-propan-2-yl-N,N-bis(trimethylsilyl)carbamimidoyl]azanide);bis(yttrium) has a molecular weight of 1324.18 g/mol, XLogP of 18.01, 16 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for tetrakis(propan-2-yl-[N'-propan-2-yl-N,N-bis(trimethylsilyl)carbamimidoyl]azanide);bis(yttrium) is sourced from PubChem (CID 11845690), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).