1,1,1-trideuterio-N,N-bis(trimethylsilyl)methanamine

C7H21NSi2 — CID 169434783

IUPAC1,1,1-trideuterio-N,N-bis(trimethylsilyl)methanamine
SMILES[2H]C([2H])([2H])N([Si](C)(C)C)[Si](C)(C)C
InChIInChI=1S/C7H21NSi2/c1-8(9(2,3)4)10(5,6)7/h1-7H3/i1D3
InChIKeyZSMNRKGGHXLZEC-FIBGUPNXSA-N
MW178.44 g/mol
LogP2.59
Rot. Bonds3

About 1,1,1-trideuterio-N,N-bis(trimethylsilyl)methanamine

1,1,1-trideuterio-N,N-bis(trimethylsilyl)methanamine (PubChem CID 169434783) has the molecular formula C7H21NSi2 and a molecular weight of 178.44 g/mol. Its IUPAC name is 1,1,1-trideuterio-N,N-bis(trimethylsilyl)methanamine.

Molecular Properties

Compound Name1,1,1-trideuterio-N,N-bis(trimethylsilyl)methanamine
PubChem CID169434783
Molecular FormulaC7H21NSi2
Molecular Weight178.44 g/mol
Exact Mass178.14
IUPAC Name1,1,1-trideuterio-N,N-bis(trimethylsilyl)methanamine
SMILES[2H]C([2H])([2H])N([Si](C)(C)C)[Si](C)(C)C
InChIInChI=1S/C7H21NSi2/c1-8(9(2,3)4)10(5,6)7/h1-7H3/i1D3
InChIKeyZSMNRKGGHXLZEC-FIBGUPNXSA-N
XLogP2.59
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.44
LogP ≤ 52.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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 1,1,1-trideuterio-N,N-bis(trimethylsilyl)methanamine?
The IUPAC name of 1,1,1-trideuterio-N,N-bis(trimethylsilyl)methanamine (CID 169434783) is 1,1,1-trideuterio-N,N-bis(trimethylsilyl)methanamine.
What is the SMILES notation for 1,1,1-trideuterio-N,N-bis(trimethylsilyl)methanamine?
The canonical SMILES for 1,1,1-trideuterio-N,N-bis(trimethylsilyl)methanamine is [2H]C([2H])([2H])N([Si](C)(C)C)[Si](C)(C)C.
What is the InChIKey of 1,1,1-trideuterio-N,N-bis(trimethylsilyl)methanamine?
The InChIKey is ZSMNRKGGHXLZEC-FIBGUPNXSA-N. The full InChI is InChI=1S/C7H21NSi2/c1-8(9(2,3)4)10(5,6)7/h1-7H3/i1D3.
What are the key properties of 1,1,1-trideuterio-N,N-bis(trimethylsilyl)methanamine?
1,1,1-trideuterio-N,N-bis(trimethylsilyl)methanamine has a molecular weight of 178.44 g/mol, XLogP of 2.59, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1,1-trideuterio-N,N-bis(trimethylsilyl)methanamine is sourced from PubChem (CID 169434783), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).