1-(6-fluoroquinoxalin-2-yl)but-3-ynyl-trimethylsilane

C15H17FN2Si — CID 142776934

IUPAC1-(6-fluoroquinoxalin-2-yl)but-3-ynyl-trimethylsilane
SMILESC#CCC(c1cnc2cc(F)ccc2n1)[Si](C)(C)C
InChIInChI=1S/C15H17FN2Si/c1-5-6-15(19(2,3)4)14-10-17-13-9-11(16)7-8-12(13)18-14/h1,7-10,15H,6H2,2-4H3
InChIKeySWIDSYQLQMYAJC-UHFFFAOYSA-N
MW272.40 g/mol
LogP3.75
Rot. Bonds3

About 1-(6-fluoroquinoxalin-2-yl)but-3-ynyl-trimethylsilane

1-(6-fluoroquinoxalin-2-yl)but-3-ynyl-trimethylsilane (PubChem CID 142776934) has the molecular formula C15H17FN2Si and a molecular weight of 272.40 g/mol. Its IUPAC name is 1-(6-fluoroquinoxalin-2-yl)but-3-ynyl-trimethylsilane.

Molecular Properties

Compound Name1-(6-fluoroquinoxalin-2-yl)but-3-ynyl-trimethylsilane
PubChem CID142776934
Molecular FormulaC15H17FN2Si
Molecular Weight272.40 g/mol
Exact Mass272.11
IUPAC Name1-(6-fluoroquinoxalin-2-yl)but-3-ynyl-trimethylsilane
SMILESC#CCC(c1cnc2cc(F)ccc2n1)[Si](C)(C)C
InChIInChI=1S/C15H17FN2Si/c1-5-6-15(19(2,3)4)14-10-17-13-9-11(16)7-8-12(13)18-14/h1,7-10,15H,6H2,2-4H3
InChIKeySWIDSYQLQMYAJC-UHFFFAOYSA-N
XLogP3.75
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.40
LogP ≤ 53.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

6-fluoro-2-propylquinoxaline
CID 144941009
1-quinoxalin-2-ylbut-3-yn-1-ol
CID 86630247
(4-fluoro-2-methylphenyl)-quinoxalin-2-ylmethanamine
CID 107357093
2-(2-bromo-5-fluorophenyl)-1-quinoxalin-2-ylethanamine
CID 107357047
2-(5-fluoro-2-methylphenyl)-1-quinoxalin-2-ylethanol
CID 107357762
(7-fluoroquinoxalin-2-yl)-trimethylstannane
CID 131748668
1-(5-fluoro-2-pyridinyl)-N-propan-2-ylbut-3-yn-1-amine
CID 79713467
7-fluoro-3-propan-2-ylquinoline
CID 118097497
6-fluoro-3-propan-2-ylquinoline
CID 90132820
1-fluoro-4-pent-4-yn-2-ylbenzene
CID 83930939
6-fluoro-2,3-bis(fluoromethyl)quinoxaline
CID 71580364
2-(3-fluorophenyl)-1-quinoxalin-2-ylethanol
CID 107357548

Frequently Asked Questions

What is the IUPAC name of 1-(6-fluoroquinoxalin-2-yl)but-3-ynyl-trimethylsilane?
The IUPAC name of 1-(6-fluoroquinoxalin-2-yl)but-3-ynyl-trimethylsilane (CID 142776934) is 1-(6-fluoroquinoxalin-2-yl)but-3-ynyl-trimethylsilane.
What is the SMILES notation for 1-(6-fluoroquinoxalin-2-yl)but-3-ynyl-trimethylsilane?
The canonical SMILES for 1-(6-fluoroquinoxalin-2-yl)but-3-ynyl-trimethylsilane is C#CCC(c1cnc2cc(F)ccc2n1)[Si](C)(C)C.
What is the InChIKey of 1-(6-fluoroquinoxalin-2-yl)but-3-ynyl-trimethylsilane?
The InChIKey is SWIDSYQLQMYAJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17FN2Si/c1-5-6-15(19(2,3)4)14-10-17-13-9-11(16)7-8-12(13)18-14/h1,7-10,15H,6H2,2-4H3.
What are the key properties of 1-(6-fluoroquinoxalin-2-yl)but-3-ynyl-trimethylsilane?
1-(6-fluoroquinoxalin-2-yl)but-3-ynyl-trimethylsilane has a molecular weight of 272.40 g/mol, XLogP of 3.75, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-fluoroquinoxalin-2-yl)but-3-ynyl-trimethylsilane is sourced from PubChem (CID 142776934), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).