1-N,1-N,1-N',1-N'-tetraphenyl-1-silylpropane-1,1-diamine

C27H28N2Si — CID 173414497

IUPAC1-N,1-N,1-N',1-N'-tetraphenyl-1-silylpropane-1,1-diamine
SMILESCCC([SiH3])(N(c1ccccc1)c1ccccc1)N(c1ccccc1)c1ccccc1
InChIInChI=1S/C27H28N2Si/c1-2-27(30,28(23-15-7-3-8-16-23)24-17-9-4-10-18-24)29(25-19-11-5-12-20-25)26-21-13-6-14-22-26/h3-22H,2H2,1,30H3
InChIKeyZFORXTODGCHAAS-UHFFFAOYSA-N
MW408.62 g/mol
LogP6.09
Rot. Bonds7

About 1-N,1-N,1-N',1-N'-tetraphenyl-1-silylpropane-1,1-diamine

1-N,1-N,1-N',1-N'-tetraphenyl-1-silylpropane-1,1-diamine (PubChem CID 173414497) has the molecular formula C27H28N2Si and a molecular weight of 408.62 g/mol. Its IUPAC name is 1-N,1-N,1-N',1-N'-tetraphenyl-1-silylpropane-1,1-diamine.

Molecular Properties

Compound Name1-N,1-N,1-N',1-N'-tetraphenyl-1-silylpropane-1,1-diamine
PubChem CID173414497
Molecular FormulaC27H28N2Si
Molecular Weight408.62 g/mol
Exact Mass408.20
IUPAC Name1-N,1-N,1-N',1-N'-tetraphenyl-1-silylpropane-1,1-diamine
SMILESCCC([SiH3])(N(c1ccccc1)c1ccccc1)N(c1ccccc1)c1ccccc1
InChIInChI=1S/C27H28N2Si/c1-2-27(30,28(23-15-7-3-8-16-23)24-17-9-4-10-18-24)29(25-19-11-5-12-20-25)26-21-13-6-14-22-26/h3-22H,2H2,1,30H3
InChIKeyZFORXTODGCHAAS-UHFFFAOYSA-N
XLogP6.09
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500408.62
LogP ≤ 56.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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',1-N'-tetraphenyl-1-silylpropane-1,1-diamine?
The IUPAC name of 1-N,1-N,1-N',1-N'-tetraphenyl-1-silylpropane-1,1-diamine (CID 173414497) is 1-N,1-N,1-N',1-N'-tetraphenyl-1-silylpropane-1,1-diamine.
What is the SMILES notation for 1-N,1-N,1-N',1-N'-tetraphenyl-1-silylpropane-1,1-diamine?
The canonical SMILES for 1-N,1-N,1-N',1-N'-tetraphenyl-1-silylpropane-1,1-diamine is CCC([SiH3])(N(c1ccccc1)c1ccccc1)N(c1ccccc1)c1ccccc1.
What is the InChIKey of 1-N,1-N,1-N',1-N'-tetraphenyl-1-silylpropane-1,1-diamine?
The InChIKey is ZFORXTODGCHAAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H28N2Si/c1-2-27(30,28(23-15-7-3-8-16-23)24-17-9-4-10-18-24)29(25-19-11-5-12-20-25)26-21-13-6-14-22-26/h3-22H,2H2,1,30H3.
What are the key properties of 1-N,1-N,1-N',1-N'-tetraphenyl-1-silylpropane-1,1-diamine?
1-N,1-N,1-N',1-N'-tetraphenyl-1-silylpropane-1,1-diamine has a molecular weight of 408.62 g/mol, XLogP of 6.09, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N,1-N,1-N',1-N'-tetraphenyl-1-silylpropane-1,1-diamine is sourced from PubChem (CID 173414497), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).