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

C21H44N4Si — CID 173002311

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

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

1-N,1-N',2-N-tricyclohexyl-1-N"-silylpropane-1,1,1,2-tetramine (PubChem CID 173002311) 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-1-N"-silylpropane-1,1,1,2-tetramine.

Molecular Properties

Compound Name1-N,1-N',2-N-tricyclohexyl-1-N"-silylpropane-1,1,1,2-tetramine
PubChem CID173002311
Molecular FormulaC21H44N4Si
Molecular Weight380.70 g/mol
Exact Mass380.33
IUPAC Name1-N,1-N',2-N-tricyclohexyl-1-N"-silylpropane-1,1,1,2-tetramine
SMILESCC(NC1CCCCC1)C(N[SiH3])(NC1CCCCC1)NC1CCCCC1
InChIInChI=1S/C21H44N4Si/c1-17(22-18-11-5-2-6-12-18)21(25-26,23-19-13-7-3-8-14-19)24-20-15-9-4-10-16-20/h17-20,22-25H,2-16H2,1,26H3
InChIKeyGOTRPQICYHQKCR-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-1-N"-silylpropane-1,1,1,2-tetramine with MolForge

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Related Compounds

1-N',1-N",2-N-tricyclohexylpropane-1,1,1,2-tetramine
CID 87082374
N-(3,3-dimethylbutan-2-yl)cyclododecanamine
CID 104827794
N-(3,3-dimethylbutan-2-yl)cyclooctanamine
CID 104827916
N-propan-2-ylcycloheptanamine
CID 42562651
N-(2,3-dimethylbutan-2-yl)cyclohexanamine
CID 89164056
N-[(1S)-1-cycloheptylethyl]cycloheptanamine
CID 81389840
N-(3-methylbutan-2-yl)cycloheptanamine
CID 43181172
N-(1-cyclopropylethyl)cyclohexanamine
CID 43177177
(2S)-2-(cyclohexylamino)propanoic acid;(2S)-2-(cyclopentylamino)propanoic acid
CID 118008390
1-(cyclopentylamino)ethanol
CID 18784157
N-cyclohexyl-2-(cyclooctylamino)propanamide
CID 43083622
2-(cycloheptylamino)-N-cyclohexylpropanamide
CID 43236394

Frequently Asked Questions

What is the IUPAC name of 1-N,1-N',2-N-tricyclohexyl-1-N"-silylpropane-1,1,1,2-tetramine?
The IUPAC name of 1-N,1-N',2-N-tricyclohexyl-1-N"-silylpropane-1,1,1,2-tetramine (CID 173002311) is 1-N,1-N',2-N-tricyclohexyl-1-N"-silylpropane-1,1,1,2-tetramine.
What is the SMILES notation for 1-N,1-N',2-N-tricyclohexyl-1-N"-silylpropane-1,1,1,2-tetramine?
The canonical SMILES for 1-N,1-N',2-N-tricyclohexyl-1-N"-silylpropane-1,1,1,2-tetramine is CC(NC1CCCCC1)C(N[SiH3])(NC1CCCCC1)NC1CCCCC1.
What is the InChIKey of 1-N,1-N',2-N-tricyclohexyl-1-N"-silylpropane-1,1,1,2-tetramine?
The InChIKey is GOTRPQICYHQKCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H44N4Si/c1-17(22-18-11-5-2-6-12-18)21(25-26,23-19-13-7-3-8-14-19)24-20-15-9-4-10-16-20/h17-20,22-25H,2-16H2,1,26H3.
What are the key properties of 1-N,1-N',2-N-tricyclohexyl-1-N"-silylpropane-1,1,1,2-tetramine?
1-N,1-N',2-N-tricyclohexyl-1-N"-silylpropane-1,1,1,2-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-1-N"-silylpropane-1,1,1,2-tetramine is sourced from PubChem (CID 173002311), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).