1-N,1-N',2-N-tributyl-2-N'-silylpropane-1,1,2,2-tetramine

C15H38N4Si — CID 123246533

IUPAC1-N,1-N',2-N-tributyl-2-N'-silylpropane-1,1,2,2-tetramine
SMILESCCCCNC(NCCCC)C(C)(N[SiH3])NCCCC
InChIInChI=1S/C15H38N4Si/c1-5-8-11-16-14(17-12-9-6-2)15(4,19-20)18-13-10-7-3/h14,16-19H,5-13H2,1-4,20H3
InChIKeyKFXIHWKOMXEJPA-UHFFFAOYSA-N
MW302.58 g/mol
LogP1.07
Rot. Bonds14

About 1-N,1-N',2-N-tributyl-2-N'-silylpropane-1,1,2,2-tetramine

1-N,1-N',2-N-tributyl-2-N'-silylpropane-1,1,2,2-tetramine (PubChem CID 123246533) has the molecular formula C15H38N4Si and a molecular weight of 302.58 g/mol. Its IUPAC name is 1-N,1-N',2-N-tributyl-2-N'-silylpropane-1,1,2,2-tetramine.

Molecular Properties

Compound Name1-N,1-N',2-N-tributyl-2-N'-silylpropane-1,1,2,2-tetramine
PubChem CID123246533
Molecular FormulaC15H38N4Si
Molecular Weight302.58 g/mol
Exact Mass302.29
IUPAC Name1-N,1-N',2-N-tributyl-2-N'-silylpropane-1,1,2,2-tetramine
SMILESCCCCNC(NCCCC)C(C)(N[SiH3])NCCCC
InChIInChI=1S/C15H38N4Si/c1-5-8-11-16-14(17-12-9-6-2)15(4,19-20)18-13-10-7-3/h14,16-19H,5-13H2,1-4,20H3
InChIKeyKFXIHWKOMXEJPA-UHFFFAOYSA-N
XLogP1.07
TPSA48.12 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds14
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.58
LogP ≤ 51.07
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-N,1-N',2-N-tributyl-2-N'-silylpropane-1,1,2,2-tetramine?
The IUPAC name of 1-N,1-N',2-N-tributyl-2-N'-silylpropane-1,1,2,2-tetramine (CID 123246533) is 1-N,1-N',2-N-tributyl-2-N'-silylpropane-1,1,2,2-tetramine.
What is the SMILES notation for 1-N,1-N',2-N-tributyl-2-N'-silylpropane-1,1,2,2-tetramine?
The canonical SMILES for 1-N,1-N',2-N-tributyl-2-N'-silylpropane-1,1,2,2-tetramine is CCCCNC(NCCCC)C(C)(N[SiH3])NCCCC.
What is the InChIKey of 1-N,1-N',2-N-tributyl-2-N'-silylpropane-1,1,2,2-tetramine?
The InChIKey is KFXIHWKOMXEJPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H38N4Si/c1-5-8-11-16-14(17-12-9-6-2)15(4,19-20)18-13-10-7-3/h14,16-19H,5-13H2,1-4,20H3.
What are the key properties of 1-N,1-N',2-N-tributyl-2-N'-silylpropane-1,1,2,2-tetramine?
1-N,1-N',2-N-tributyl-2-N'-silylpropane-1,1,2,2-tetramine has a molecular weight of 302.58 g/mol, XLogP of 1.07, 14 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N,1-N',2-N-tributyl-2-N'-silylpropane-1,1,2,2-tetramine is sourced from PubChem (CID 123246533), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).