1-Boranylidene-N,N,N',N',N'',N''-hexamethyl-lambda~5~-phosphanetriamine

C6H18BN3P — CID 6327645

IUPAC—
SMILES[B]=P(N(C)C)(N(C)C)N(C)C
InChIInChI=1S/C6H18BN3P/c1-8(2)11(7,9(3)4)10(5)6/h1-6H3
InChIKeyDXRKRSKHSZFAHY-UHFFFAOYSA-N
MW174.02 g/mol
LogP0.52
Rot. Bonds3

About 1-Boranylidene-N,N,N',N',N'',N''-hexamethyl-lambda~5~-phosphanetriamine

1-Boranylidene-N,N,N',N',N'',N''-hexamethyl-lambda~5~-phosphanetriamine (PubChem CID 6327645) has the molecular formula C6H18BN3P and a molecular weight of 174.02 g/mol.

Molecular Properties

Compound Name1-Boranylidene-N,N,N',N',N'',N''-hexamethyl-lambda~5~-phosphanetriamine
PubChem CID6327645
Molecular FormulaC6H18BN3P
Molecular Weight174.02 g/mol
Exact Mass174.13
IUPAC Name—
SMILES[B]=P(N(C)C)(N(C)C)N(C)C
InChIInChI=1S/C6H18BN3P/c1-8(2)11(7,9(3)4)10(5)6/h1-6H3
InChIKeyDXRKRSKHSZFAHY-UHFFFAOYSA-N
XLogP0.52
TPSA9.72 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.02
LogP ≤ 50.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 1-Boranylidene-N,N,N',N',N'',N''-hexamethyl-lambda~5~-phosphanetriamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-Boranylidene-N,N,N',N',N'',N''-hexamethyl-lambda~5~-phosphanetriamine?
The IUPAC name of 1-Boranylidene-N,N,N',N',N'',N''-hexamethyl-lambda~5~-phosphanetriamine (CID 6327645) is not available.
What is the SMILES notation for 1-Boranylidene-N,N,N',N',N'',N''-hexamethyl-lambda~5~-phosphanetriamine?
The canonical SMILES for 1-Boranylidene-N,N,N',N',N'',N''-hexamethyl-lambda~5~-phosphanetriamine is [B]=P(N(C)C)(N(C)C)N(C)C.
What is the InChIKey of 1-Boranylidene-N,N,N',N',N'',N''-hexamethyl-lambda~5~-phosphanetriamine?
The InChIKey is DXRKRSKHSZFAHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H18BN3P/c1-8(2)11(7,9(3)4)10(5)6/h1-6H3.
What are the key properties of 1-Boranylidene-N,N,N',N',N'',N''-hexamethyl-lambda~5~-phosphanetriamine?
1-Boranylidene-N,N,N',N',N'',N''-hexamethyl-lambda~5~-phosphanetriamine has a molecular weight of 174.02 g/mol, XLogP of 0.52, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-Boranylidene-N,N,N',N',N'',N''-hexamethyl-lambda~5~-phosphanetriamine is sourced from PubChem (CID 6327645), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).