1-N,1-N,3-N,3-N-tetrakis(trimethylsilyl)benzene-1,3-diamine

C18H40N2Si4 — CID 15443940

IUPAC1-N,1-N,3-N,3-N-tetrakis(trimethylsilyl)benzene-1,3-diamine
SMILESC[Si](C)(C)N(c1cccc(N([Si](C)(C)C)[Si](C)(C)C)c1)[Si](C)(C)C
InChIInChI=1S/C18H40N2Si4/c1-21(2,3)19(22(4,5)6)17-14-13-15-18(16-17)20(23(7,8)9)24(10,11)12/h13-16H,1-12H3
InChIKeyVOLZDZPLYOEYCO-UHFFFAOYSA-N
MW396.88 g/mol
LogP6.64
Rot. Bonds6

About 1-N,1-N,3-N,3-N-tetrakis(trimethylsilyl)benzene-1,3-diamine

1-N,1-N,3-N,3-N-tetrakis(trimethylsilyl)benzene-1,3-diamine (PubChem CID 15443940) has the molecular formula C18H40N2Si4 and a molecular weight of 396.88 g/mol. Its IUPAC name is 1-N,1-N,3-N,3-N-tetrakis(trimethylsilyl)benzene-1,3-diamine.

Molecular Properties

Compound Name1-N,1-N,3-N,3-N-tetrakis(trimethylsilyl)benzene-1,3-diamine
PubChem CID15443940
Molecular FormulaC18H40N2Si4
Molecular Weight396.88 g/mol
Exact Mass396.23
IUPAC Name1-N,1-N,3-N,3-N-tetrakis(trimethylsilyl)benzene-1,3-diamine
SMILESC[Si](C)(C)N(c1cccc(N([Si](C)(C)C)[Si](C)(C)C)c1)[Si](C)(C)C
InChIInChI=1S/C18H40N2Si4/c1-21(2,3)19(22(4,5)6)17-14-13-15-18(16-17)20(23(7,8)9)24(10,11)12/h13-16H,1-12H3
InChIKeyVOLZDZPLYOEYCO-UHFFFAOYSA-N
XLogP6.64
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms24
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500396.88
LogP ≤ 56.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-N,1-N,3-N,3-N-tetrakis(trimethylsilyl)benzene-1,3-diamine?
The IUPAC name of 1-N,1-N,3-N,3-N-tetrakis(trimethylsilyl)benzene-1,3-diamine (CID 15443940) is 1-N,1-N,3-N,3-N-tetrakis(trimethylsilyl)benzene-1,3-diamine.
What is the SMILES notation for 1-N,1-N,3-N,3-N-tetrakis(trimethylsilyl)benzene-1,3-diamine?
The canonical SMILES for 1-N,1-N,3-N,3-N-tetrakis(trimethylsilyl)benzene-1,3-diamine is C[Si](C)(C)N(c1cccc(N([Si](C)(C)C)[Si](C)(C)C)c1)[Si](C)(C)C.
What is the InChIKey of 1-N,1-N,3-N,3-N-tetrakis(trimethylsilyl)benzene-1,3-diamine?
The InChIKey is VOLZDZPLYOEYCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H40N2Si4/c1-21(2,3)19(22(4,5)6)17-14-13-15-18(16-17)20(23(7,8)9)24(10,11)12/h13-16H,1-12H3.
What are the key properties of 1-N,1-N,3-N,3-N-tetrakis(trimethylsilyl)benzene-1,3-diamine?
1-N,1-N,3-N,3-N-tetrakis(trimethylsilyl)benzene-1,3-diamine has a molecular weight of 396.88 g/mol, XLogP of 6.64, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N,1-N,3-N,3-N-tetrakis(trimethylsilyl)benzene-1,3-diamine is sourced from PubChem (CID 15443940), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).