N-benzyl-5-trimethylsilyl-N-(5-trimethylsilylpenta-2,4-diynyl)penta-2,4-diyn-1-amine

C23H29NSi2 — CID 59398634

IUPACN-benzyl-5-trimethylsilyl-N-(5-trimethylsilylpenta-2,4-diynyl)penta-2,4-diyn-1-amine
SMILESC[Si](C)(C)C#CC#CCN(CC#CC#C[Si](C)(C)C)Cc1ccccc1
InChIInChI=1S/C23H29NSi2/c1-25(2,3)20-14-8-12-18-24(22-23-16-10-7-11-17-23)19-13-9-15-21-26(4,5)6/h7,10-11,16-17H,18-19,22H2,1-6H3
InChIKeyMHWGQYNFWMMFNU-UHFFFAOYSA-N
MW375.66 g/mol
LogP4.26
Rot. Bonds4

About N-benzyl-5-trimethylsilyl-N-(5-trimethylsilylpenta-2,4-diynyl)penta-2,4-diyn-1-amine

N-benzyl-5-trimethylsilyl-N-(5-trimethylsilylpenta-2,4-diynyl)penta-2,4-diyn-1-amine (PubChem CID 59398634) has the molecular formula C23H29NSi2 and a molecular weight of 375.66 g/mol. Its IUPAC name is N-benzyl-5-trimethylsilyl-N-(5-trimethylsilylpenta-2,4-diynyl)penta-2,4-diyn-1-amine.

Molecular Properties

Compound NameN-benzyl-5-trimethylsilyl-N-(5-trimethylsilylpenta-2,4-diynyl)penta-2,4-diyn-1-amine
PubChem CID59398634
Molecular FormulaC23H29NSi2
Molecular Weight375.66 g/mol
Exact Mass375.18
IUPAC NameN-benzyl-5-trimethylsilyl-N-(5-trimethylsilylpenta-2,4-diynyl)penta-2,4-diyn-1-amine
SMILESC[Si](C)(C)C#CC#CCN(CC#CC#C[Si](C)(C)C)Cc1ccccc1
InChIInChI=1S/C23H29NSi2/c1-25(2,3)20-14-8-12-18-24(22-23-16-10-7-11-17-23)19-13-9-15-21-26(4,5)6/h7,10-11,16-17H,18-19,22H2,1-6H3
InChIKeyMHWGQYNFWMMFNU-UHFFFAOYSA-N
XLogP4.26
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.66
LogP ≤ 54.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'triple_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-benzyl-5-trimethylsilyl-N-(5-trimethylsilylpenta-2,4-diynyl)penta-2,4-diyn-1-amine?
The IUPAC name of N-benzyl-5-trimethylsilyl-N-(5-trimethylsilylpenta-2,4-diynyl)penta-2,4-diyn-1-amine (CID 59398634) is N-benzyl-5-trimethylsilyl-N-(5-trimethylsilylpenta-2,4-diynyl)penta-2,4-diyn-1-amine.
What is the SMILES notation for N-benzyl-5-trimethylsilyl-N-(5-trimethylsilylpenta-2,4-diynyl)penta-2,4-diyn-1-amine?
The canonical SMILES for N-benzyl-5-trimethylsilyl-N-(5-trimethylsilylpenta-2,4-diynyl)penta-2,4-diyn-1-amine is C[Si](C)(C)C#CC#CCN(CC#CC#C[Si](C)(C)C)Cc1ccccc1.
What is the InChIKey of N-benzyl-5-trimethylsilyl-N-(5-trimethylsilylpenta-2,4-diynyl)penta-2,4-diyn-1-amine?
The InChIKey is MHWGQYNFWMMFNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H29NSi2/c1-25(2,3)20-14-8-12-18-24(22-23-16-10-7-11-17-23)19-13-9-15-21-26(4,5)6/h7,10-11,16-17H,18-19,22H2,1-6H3.
What are the key properties of N-benzyl-5-trimethylsilyl-N-(5-trimethylsilylpenta-2,4-diynyl)penta-2,4-diyn-1-amine?
N-benzyl-5-trimethylsilyl-N-(5-trimethylsilylpenta-2,4-diynyl)penta-2,4-diyn-1-amine has a molecular weight of 375.66 g/mol, XLogP of 4.26, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-5-trimethylsilyl-N-(5-trimethylsilylpenta-2,4-diynyl)penta-2,4-diyn-1-amine is sourced from PubChem (CID 59398634), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).