1-N,1-N',1-N"-triethyl-3-N-silylpropane-1,1,1,3-tetramine

C9H26N4Si — CID 123399195

IUPAC1-N,1-N',1-N"-triethyl-3-N-silylpropane-1,1,1,3-tetramine
SMILESCCNC(CCN[SiH3])(NCC)NCC
InChIInChI=1S/C9H26N4Si/c1-4-10-9(11-5-2,12-6-3)7-8-13-14/h10-13H,4-8H2,1-3,14H3
InChIKeyBNYLKUOTUVKVSH-UHFFFAOYSA-N
MW218.42 g/mol
LogP-1.27
Rot. Bonds9

About 1-N,1-N',1-N"-triethyl-3-N-silylpropane-1,1,1,3-tetramine

1-N,1-N',1-N"-triethyl-3-N-silylpropane-1,1,1,3-tetramine (PubChem CID 123399195) has the molecular formula C9H26N4Si and a molecular weight of 218.42 g/mol. Its IUPAC name is 1-N,1-N',1-N"-triethyl-3-N-silylpropane-1,1,1,3-tetramine.

Molecular Properties

Compound Name1-N,1-N',1-N"-triethyl-3-N-silylpropane-1,1,1,3-tetramine
PubChem CID123399195
Molecular FormulaC9H26N4Si
Molecular Weight218.42 g/mol
Exact Mass218.19
IUPAC Name1-N,1-N',1-N"-triethyl-3-N-silylpropane-1,1,1,3-tetramine
SMILESCCNC(CCN[SiH3])(NCC)NCC
InChIInChI=1S/C9H26N4Si/c1-4-10-9(11-5-2,12-6-3)7-8-13-14/h10-13H,4-8H2,1-3,14H3
InChIKeyBNYLKUOTUVKVSH-UHFFFAOYSA-N
XLogP-1.27
TPSA48.12 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.42
LogP ≤ 5-1.27
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'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',1-N"-triethyl-3-N-silylpropane-1,1,1,3-tetramine?
The IUPAC name of 1-N,1-N',1-N"-triethyl-3-N-silylpropane-1,1,1,3-tetramine (CID 123399195) is 1-N,1-N',1-N"-triethyl-3-N-silylpropane-1,1,1,3-tetramine.
What is the SMILES notation for 1-N,1-N',1-N"-triethyl-3-N-silylpropane-1,1,1,3-tetramine?
The canonical SMILES for 1-N,1-N',1-N"-triethyl-3-N-silylpropane-1,1,1,3-tetramine is CCNC(CCN[SiH3])(NCC)NCC.
What is the InChIKey of 1-N,1-N',1-N"-triethyl-3-N-silylpropane-1,1,1,3-tetramine?
The InChIKey is BNYLKUOTUVKVSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H26N4Si/c1-4-10-9(11-5-2,12-6-3)7-8-13-14/h10-13H,4-8H2,1-3,14H3.
What are the key properties of 1-N,1-N',1-N"-triethyl-3-N-silylpropane-1,1,1,3-tetramine?
1-N,1-N',1-N"-triethyl-3-N-silylpropane-1,1,1,3-tetramine has a molecular weight of 218.42 g/mol, XLogP of -1.27, 9 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N,1-N',1-N"-triethyl-3-N-silylpropane-1,1,1,3-tetramine is sourced from PubChem (CID 123399195), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).