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

C21H44N4Si — CID 123340291

IUPAC1-N,1-N',2-N-tricyclohexyl-2-N'-silylpropane-1,1,2,2-tetramine
SMILESCC(N[SiH3])(NC1CCCCC1)C(NC1CCCCC1)NC1CCCCC1
InChIInChI=1S/C21H44N4Si/c1-21(25-26,24-19-15-9-4-10-16-19)20(22-17-11-5-2-6-12-17)23-18-13-7-3-8-14-18/h17-20,22-25H,2-16H2,1,26H3
InChIKeyDPLKJSOPGFKWQF-UHFFFAOYSA-N
MW380.70 g/mol
LogP2.67
Rot. Bonds8

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

1-N,1-N',2-N-tricyclohexyl-2-N'-silylpropane-1,1,2,2-tetramine (PubChem CID 123340291) has the molecular formula C21H44N4Si and a molecular weight of 380.70 g/mol. Its IUPAC name is 1-N,1-N',2-N-tricyclohexyl-2-N'-silylpropane-1,1,2,2-tetramine.

Molecular Properties

Compound Name1-N,1-N',2-N-tricyclohexyl-2-N'-silylpropane-1,1,2,2-tetramine
PubChem CID123340291
Molecular FormulaC21H44N4Si
Molecular Weight380.70 g/mol
Exact Mass380.33
IUPAC Name1-N,1-N',2-N-tricyclohexyl-2-N'-silylpropane-1,1,2,2-tetramine
SMILESCC(N[SiH3])(NC1CCCCC1)C(NC1CCCCC1)NC1CCCCC1
InChIInChI=1S/C21H44N4Si/c1-21(25-26,24-19-15-9-4-10-16-19)20(22-17-11-5-2-6-12-17)23-18-13-7-3-8-14-18/h17-20,22-25H,2-16H2,1,26H3
InChIKeyDPLKJSOPGFKWQF-UHFFFAOYSA-N
XLogP2.67
TPSA48.12 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.70
LogP ≤ 52.67
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'}

Analyze 1-N,1-N',2-N-tricyclohexyl-2-N'-silylpropane-1,1,2,2-tetramine 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-N,1-N',2-N-tricyclohexyl-2-N'-silylpropane-1,1,2,2-tetramine?
The IUPAC name of 1-N,1-N',2-N-tricyclohexyl-2-N'-silylpropane-1,1,2,2-tetramine (CID 123340291) is 1-N,1-N',2-N-tricyclohexyl-2-N'-silylpropane-1,1,2,2-tetramine.
What is the SMILES notation for 1-N,1-N',2-N-tricyclohexyl-2-N'-silylpropane-1,1,2,2-tetramine?
The canonical SMILES for 1-N,1-N',2-N-tricyclohexyl-2-N'-silylpropane-1,1,2,2-tetramine is CC(N[SiH3])(NC1CCCCC1)C(NC1CCCCC1)NC1CCCCC1.
What is the InChIKey of 1-N,1-N',2-N-tricyclohexyl-2-N'-silylpropane-1,1,2,2-tetramine?
The InChIKey is DPLKJSOPGFKWQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H44N4Si/c1-21(25-26,24-19-15-9-4-10-16-19)20(22-17-11-5-2-6-12-17)23-18-13-7-3-8-14-18/h17-20,22-25H,2-16H2,1,26H3.
What are the key properties of 1-N,1-N',2-N-tricyclohexyl-2-N'-silylpropane-1,1,2,2-tetramine?
1-N,1-N',2-N-tricyclohexyl-2-N'-silylpropane-1,1,2,2-tetramine has a molecular weight of 380.70 g/mol, XLogP of 2.67, 8 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-tricyclohexyl-2-N'-silylpropane-1,1,2,2-tetramine is sourced from PubChem (CID 123340291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).