triethyl-[4-[1-(6-methoxynaphthalen-2-yl)ethoxy]but-1-ynyl]silane

C23H32O2Si — CID 156596313

IUPACtriethyl-[4-[1-(6-methoxynaphthalen-2-yl)ethoxy]but-1-ynyl]silane
SMILESCC[Si](C#CCCOC(C)c1ccc2cc(OC)ccc2c1)(CC)CC
InChIInChI=1S/C23H32O2Si/c1-6-26(7-2,8-3)16-10-9-15-25-19(4)20-11-12-22-18-23(24-5)14-13-21(22)17-20/h11-14,17-19H,6-9,15H2,1-5H3
InChIKeyHGTNSISREHERMJ-UHFFFAOYSA-N
MW368.59 g/mol
LogP6.37
Rot. Bonds8

About triethyl-[4-[1-(6-methoxynaphthalen-2-yl)ethoxy]but-1-ynyl]silane

triethyl-[4-[1-(6-methoxynaphthalen-2-yl)ethoxy]but-1-ynyl]silane (PubChem CID 156596313) has the molecular formula C23H32O2Si and a molecular weight of 368.59 g/mol. Its IUPAC name is triethyl-[4-[1-(6-methoxynaphthalen-2-yl)ethoxy]but-1-ynyl]silane.

Molecular Properties

Compound Nametriethyl-[4-[1-(6-methoxynaphthalen-2-yl)ethoxy]but-1-ynyl]silane
PubChem CID156596313
Molecular FormulaC23H32O2Si
Molecular Weight368.59 g/mol
Exact Mass368.22
IUPAC Nametriethyl-[4-[1-(6-methoxynaphthalen-2-yl)ethoxy]but-1-ynyl]silane
SMILESCC[Si](C#CCCOC(C)c1ccc2cc(OC)ccc2c1)(CC)CC
InChIInChI=1S/C23H32O2Si/c1-6-26(7-2,8-3)16-10-9-15-25-19(4)20-11-12-22-18-23(24-5)14-13-21(22)17-20/h11-14,17-19H,6-9,15H2,1-5H3
InChIKeyHGTNSISREHERMJ-UHFFFAOYSA-N
XLogP6.37
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500368.59
LogP ≤ 56.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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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Related Compounds

2-methoxy-6-[1-[3-(4-methoxyphenyl)propoxy]ethyl]naphthalene
CID 156596309
1-[(1S)-1-butoxyethyl]-4-methoxybenzene
CID 102525034
N,N'-bis[1-(6-methoxynaphthalen-2-yl)ethyl]ethane-1,2-diamine
CID 23154308
N-ethyl-1-(6-methoxynaphthalen-2-yl)ethanamine
CID 24708514
1-(6-methoxynaphthalen-2-yl)propan-1-amine
CID 57010651
(2S)-2-(6-methoxynaphthalen-2-yl)propan-1-amine
CID 93286235
triethyl-[2-(4-methoxyphenoxy)ethynyl]silane
CID 102529834
1-[1-(3-chloropropoxy)ethyl]-4-methoxybenzene
CID 86112435
(1S)-2-amino-1-(6-methoxynaphthalen-2-yl)ethanol
CID 28743407
(1S)-1-(6-methoxynaphthalen-2-yl)propan-1-amine;hydrochloride
CID 171218899
N-ethyl-2-(6-methoxynaphthalen-2-yl)propan-1-amine
CID 54856188
propyl (2R)-2-(6-methoxynaphthalen-2-yl)propanoate
CID 102378352

Frequently Asked Questions

What is the IUPAC name of triethyl-[4-[1-(6-methoxynaphthalen-2-yl)ethoxy]but-1-ynyl]silane?
The IUPAC name of triethyl-[4-[1-(6-methoxynaphthalen-2-yl)ethoxy]but-1-ynyl]silane (CID 156596313) is triethyl-[4-[1-(6-methoxynaphthalen-2-yl)ethoxy]but-1-ynyl]silane.
What is the SMILES notation for triethyl-[4-[1-(6-methoxynaphthalen-2-yl)ethoxy]but-1-ynyl]silane?
The canonical SMILES for triethyl-[4-[1-(6-methoxynaphthalen-2-yl)ethoxy]but-1-ynyl]silane is CC[Si](C#CCCOC(C)c1ccc2cc(OC)ccc2c1)(CC)CC.
What is the InChIKey of triethyl-[4-[1-(6-methoxynaphthalen-2-yl)ethoxy]but-1-ynyl]silane?
The InChIKey is HGTNSISREHERMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H32O2Si/c1-6-26(7-2,8-3)16-10-9-15-25-19(4)20-11-12-22-18-23(24-5)14-13-21(22)17-20/h11-14,17-19H,6-9,15H2,1-5H3.
What are the key properties of triethyl-[4-[1-(6-methoxynaphthalen-2-yl)ethoxy]but-1-ynyl]silane?
triethyl-[4-[1-(6-methoxynaphthalen-2-yl)ethoxy]but-1-ynyl]silane has a molecular weight of 368.59 g/mol, XLogP of 6.37, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for triethyl-[4-[1-(6-methoxynaphthalen-2-yl)ethoxy]but-1-ynyl]silane is sourced from PubChem (CID 156596313), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).