6-trimethylsilylhex-4-yn-1-amine

C9H19NSi — CID 13434251

IUPAC6-trimethylsilylhex-4-yn-1-amine
SMILESC[Si](C)(C)CC#CCCCN
InChIInChI=1S/C9H19NSi/c1-11(2,3)9-7-5-4-6-8-10/h4,6,8-10H2,1-3H3
InChIKeyKXVONVDQCLRRFU-UHFFFAOYSA-N
MW169.34 g/mol
LogP2.07
Rot. Bonds3

About 6-trimethylsilylhex-4-yn-1-amine

6-trimethylsilylhex-4-yn-1-amine (PubChem CID 13434251) has the molecular formula C9H19NSi and a molecular weight of 169.34 g/mol. Its IUPAC name is 6-trimethylsilylhex-4-yn-1-amine.

Molecular Properties

Compound Name6-trimethylsilylhex-4-yn-1-amine
PubChem CID13434251
Molecular FormulaC9H19NSi
Molecular Weight169.34 g/mol
Exact Mass169.13
IUPAC Name6-trimethylsilylhex-4-yn-1-amine
SMILESC[Si](C)(C)CC#CCCCN
InChIInChI=1S/C9H19NSi/c1-11(2,3)9-7-5-4-6-8-10/h4,6,8-10H2,1-3H3
InChIKeyKXVONVDQCLRRFU-UHFFFAOYSA-N
XLogP2.07
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.34
LogP ≤ 52.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'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 6-trimethylsilylhex-4-yn-1-amine?
The IUPAC name of 6-trimethylsilylhex-4-yn-1-amine (CID 13434251) is 6-trimethylsilylhex-4-yn-1-amine.
What is the SMILES notation for 6-trimethylsilylhex-4-yn-1-amine?
The canonical SMILES for 6-trimethylsilylhex-4-yn-1-amine is C[Si](C)(C)CC#CCCCN.
What is the InChIKey of 6-trimethylsilylhex-4-yn-1-amine?
The InChIKey is KXVONVDQCLRRFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NSi/c1-11(2,3)9-7-5-4-6-8-10/h4,6,8-10H2,1-3H3.
What are the key properties of 6-trimethylsilylhex-4-yn-1-amine?
6-trimethylsilylhex-4-yn-1-amine has a molecular weight of 169.34 g/mol, XLogP of 2.07, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-trimethylsilylhex-4-yn-1-amine is sourced from PubChem (CID 13434251), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).