[1-ethyl-2-(1-phenylpent-4-enyl)cyclopropyl]oxy-trimethylsilane

C19H30OSi — CID 86222251

IUPAC[1-ethyl-2-(1-phenylpent-4-enyl)cyclopropyl]oxy-trimethylsilane
SMILESC=CCCC(c1ccccc1)C1CC1(CC)O[Si](C)(C)C
InChIInChI=1S/C19H30OSi/c1-6-8-14-17(16-12-10-9-11-13-16)18-15-19(18,7-2)20-21(3,4)5/h6,9-13,17-18H,1,7-8,14-15H2,2-5H3
InChIKeyNAIPYXVVOMGHHJ-UHFFFAOYSA-N
MW302.53 g/mol
LogP5.76
Rot. Bonds8

About [1-ethyl-2-(1-phenylpent-4-enyl)cyclopropyl]oxy-trimethylsilane

[1-ethyl-2-(1-phenylpent-4-enyl)cyclopropyl]oxy-trimethylsilane (PubChem CID 86222251) has the molecular formula C19H30OSi and a molecular weight of 302.53 g/mol. Its IUPAC name is [1-ethyl-2-(1-phenylpent-4-enyl)cyclopropyl]oxy-trimethylsilane.

Molecular Properties

Compound Name[1-ethyl-2-(1-phenylpent-4-enyl)cyclopropyl]oxy-trimethylsilane
PubChem CID86222251
Molecular FormulaC19H30OSi
Molecular Weight302.53 g/mol
Exact Mass302.21
IUPAC Name[1-ethyl-2-(1-phenylpent-4-enyl)cyclopropyl]oxy-trimethylsilane
SMILESC=CCCC(c1ccccc1)C1CC1(CC)O[Si](C)(C)C
InChIInChI=1S/C19H30OSi/c1-6-8-14-17(16-12-10-9-11-13-16)18-15-19(18,7-2)20-21(3,4)5/h6,9-13,17-18H,1,7-8,14-15H2,2-5H3
InChIKeyNAIPYXVVOMGHHJ-UHFFFAOYSA-N
XLogP5.76
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500302.53
LogP ≤ 55.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [1-ethyl-2-(1-phenylpent-4-enyl)cyclopropyl]oxy-trimethylsilane?
The IUPAC name of [1-ethyl-2-(1-phenylpent-4-enyl)cyclopropyl]oxy-trimethylsilane (CID 86222251) is [1-ethyl-2-(1-phenylpent-4-enyl)cyclopropyl]oxy-trimethylsilane.
What is the SMILES notation for [1-ethyl-2-(1-phenylpent-4-enyl)cyclopropyl]oxy-trimethylsilane?
The canonical SMILES for [1-ethyl-2-(1-phenylpent-4-enyl)cyclopropyl]oxy-trimethylsilane is C=CCCC(c1ccccc1)C1CC1(CC)O[Si](C)(C)C.
What is the InChIKey of [1-ethyl-2-(1-phenylpent-4-enyl)cyclopropyl]oxy-trimethylsilane?
The InChIKey is NAIPYXVVOMGHHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H30OSi/c1-6-8-14-17(16-12-10-9-11-13-16)18-15-19(18,7-2)20-21(3,4)5/h6,9-13,17-18H,1,7-8,14-15H2,2-5H3.
What are the key properties of [1-ethyl-2-(1-phenylpent-4-enyl)cyclopropyl]oxy-trimethylsilane?
[1-ethyl-2-(1-phenylpent-4-enyl)cyclopropyl]oxy-trimethylsilane has a molecular weight of 302.53 g/mol, XLogP of 5.76, 8 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [1-ethyl-2-(1-phenylpent-4-enyl)cyclopropyl]oxy-trimethylsilane is sourced from PubChem (CID 86222251), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).