(E)-3-methyl-5-(2,2,3-trimethylcyclopent-3-en-1-yl)-1-trimethylsilylpent-4-en-2-ol

C17H32OSi — CID 175737521

IUPAC(E)-3-methyl-5-(2,2,3-trimethylcyclopent-3-en-1-yl)-1-trimethylsilylpent-4-en-2-ol
SMILESCC1=CCC(/C=C/C(C)C(O)C[Si](C)(C)C)C1(C)C
InChIInChI=1S/C17H32OSi/c1-13(16(18)12-19(5,6)7)8-10-15-11-9-14(2)17(15,3)4/h8-10,13,15-16,18H,11-12H2,1-7H3/b10-8+
InChIKeyXVBZNDDUZXUYTO-CSKARUKUSA-N
MW280.53 g/mol
LogP4.87
Rot. Bonds5

About (E)-3-methyl-5-(2,2,3-trimethylcyclopent-3-en-1-yl)-1-trimethylsilylpent-4-en-2-ol

(E)-3-methyl-5-(2,2,3-trimethylcyclopent-3-en-1-yl)-1-trimethylsilylpent-4-en-2-ol (PubChem CID 175737521) has the molecular formula C17H32OSi and a molecular weight of 280.53 g/mol. Its IUPAC name is (E)-3-methyl-5-(2,2,3-trimethylcyclopent-3-en-1-yl)-1-trimethylsilylpent-4-en-2-ol.

Molecular Properties

Compound Name(E)-3-methyl-5-(2,2,3-trimethylcyclopent-3-en-1-yl)-1-trimethylsilylpent-4-en-2-ol
PubChem CID175737521
Molecular FormulaC17H32OSi
Molecular Weight280.53 g/mol
Exact Mass280.22
IUPAC Name(E)-3-methyl-5-(2,2,3-trimethylcyclopent-3-en-1-yl)-1-trimethylsilylpent-4-en-2-ol
SMILESCC1=CCC(/C=C/C(C)C(O)C[Si](C)(C)C)C1(C)C
InChIInChI=1S/C17H32OSi/c1-13(16(18)12-19(5,6)7)8-10-15-11-9-14(2)17(15,3)4/h8-10,13,15-16,18H,11-12H2,1-7H3/b10-8+
InChIKeyXVBZNDDUZXUYTO-CSKARUKUSA-N
XLogP4.87
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.53
LogP ≤ 54.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze (E)-3-methyl-5-(2,2,3-trimethylcyclopent-3-en-1-yl)-1-trimethylsilylpent-4-en-2-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (E)-3-methyl-5-(2,2,3-trimethylcyclopent-3-en-1-yl)-1-trimethylsilylpent-4-en-2-ol?
The IUPAC name of (E)-3-methyl-5-(2,2,3-trimethylcyclopent-3-en-1-yl)-1-trimethylsilylpent-4-en-2-ol (CID 175737521) is (E)-3-methyl-5-(2,2,3-trimethylcyclopent-3-en-1-yl)-1-trimethylsilylpent-4-en-2-ol.
What is the SMILES notation for (E)-3-methyl-5-(2,2,3-trimethylcyclopent-3-en-1-yl)-1-trimethylsilylpent-4-en-2-ol?
The canonical SMILES for (E)-3-methyl-5-(2,2,3-trimethylcyclopent-3-en-1-yl)-1-trimethylsilylpent-4-en-2-ol is CC1=CCC(/C=C/C(C)C(O)C[Si](C)(C)C)C1(C)C.
What is the InChIKey of (E)-3-methyl-5-(2,2,3-trimethylcyclopent-3-en-1-yl)-1-trimethylsilylpent-4-en-2-ol?
The InChIKey is XVBZNDDUZXUYTO-CSKARUKUSA-N. The full InChI is InChI=1S/C17H32OSi/c1-13(16(18)12-19(5,6)7)8-10-15-11-9-14(2)17(15,3)4/h8-10,13,15-16,18H,11-12H2,1-7H3/b10-8+.
What are the key properties of (E)-3-methyl-5-(2,2,3-trimethylcyclopent-3-en-1-yl)-1-trimethylsilylpent-4-en-2-ol?
(E)-3-methyl-5-(2,2,3-trimethylcyclopent-3-en-1-yl)-1-trimethylsilylpent-4-en-2-ol has a molecular weight of 280.53 g/mol, XLogP of 4.87, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-3-methyl-5-(2,2,3-trimethylcyclopent-3-en-1-yl)-1-trimethylsilylpent-4-en-2-ol is sourced from PubChem (CID 175737521), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).