(1S,5R)-2-methyl-5-prop-1-en-2-yl-1-[2-(trimethylsilylmethyl)prop-2-enyl]cyclohex-2-en-1-ol

C17H30OSi — CID 10707751

IUPAC(1S,5R)-2-methyl-5-prop-1-en-2-yl-1-[2-(trimethylsilylmethyl)prop-2-enyl]cyclohex-2-en-1-ol
SMILESC=C(C[C@@]1(O)C[C@H](C(=C)C)CC=C1C)C[Si](C)(C)C
InChIInChI=1S/C17H30OSi/c1-13(2)16-9-8-15(4)17(18,11-16)10-14(3)12-19(5,6)7/h8,16,18H,1,3,9-12H2,2,4-7H3/t16-,17-/m1/s1
InChIKeyCZLIYNZKZSPSTC-IAGOWNOFSA-N
MW278.51 g/mol
LogP4.93
Rot. Bonds5

About (1S,5R)-2-methyl-5-prop-1-en-2-yl-1-[2-(trimethylsilylmethyl)prop-2-enyl]cyclohex-2-en-1-ol

(1S,5R)-2-methyl-5-prop-1-en-2-yl-1-[2-(trimethylsilylmethyl)prop-2-enyl]cyclohex-2-en-1-ol (PubChem CID 10707751) has the molecular formula C17H30OSi and a molecular weight of 278.51 g/mol. Its IUPAC name is (1S,5R)-2-methyl-5-prop-1-en-2-yl-1-[2-(trimethylsilylmethyl)prop-2-enyl]cyclohex-2-en-1-ol.

Molecular Properties

Compound Name(1S,5R)-2-methyl-5-prop-1-en-2-yl-1-[2-(trimethylsilylmethyl)prop-2-enyl]cyclohex-2-en-1-ol
PubChem CID10707751
Molecular FormulaC17H30OSi
Molecular Weight278.51 g/mol
Exact Mass278.21
IUPAC Name(1S,5R)-2-methyl-5-prop-1-en-2-yl-1-[2-(trimethylsilylmethyl)prop-2-enyl]cyclohex-2-en-1-ol
SMILESC=C(C[C@@]1(O)C[C@H](C(=C)C)CC=C1C)C[Si](C)(C)C
InChIInChI=1S/C17H30OSi/c1-13(2)16-9-8-15(4)17(18,11-16)10-14(3)12-19(5,6)7/h8,16,18H,1,3,9-12H2,2,4-7H3/t16-,17-/m1/s1
InChIKeyCZLIYNZKZSPSTC-IAGOWNOFSA-N
XLogP4.93
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.51
LogP ≤ 54.93
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 (1S,5R)-2-methyl-5-prop-1-en-2-yl-1-[2-(trimethylsilylmethyl)prop-2-enyl]cyclohex-2-en-1-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 (1S,5R)-2-methyl-5-prop-1-en-2-yl-1-[2-(trimethylsilylmethyl)prop-2-enyl]cyclohex-2-en-1-ol?
The IUPAC name of (1S,5R)-2-methyl-5-prop-1-en-2-yl-1-[2-(trimethylsilylmethyl)prop-2-enyl]cyclohex-2-en-1-ol (CID 10707751) is (1S,5R)-2-methyl-5-prop-1-en-2-yl-1-[2-(trimethylsilylmethyl)prop-2-enyl]cyclohex-2-en-1-ol.
What is the SMILES notation for (1S,5R)-2-methyl-5-prop-1-en-2-yl-1-[2-(trimethylsilylmethyl)prop-2-enyl]cyclohex-2-en-1-ol?
The canonical SMILES for (1S,5R)-2-methyl-5-prop-1-en-2-yl-1-[2-(trimethylsilylmethyl)prop-2-enyl]cyclohex-2-en-1-ol is C=C(C[C@@]1(O)C[C@H](C(=C)C)CC=C1C)C[Si](C)(C)C.
What is the InChIKey of (1S,5R)-2-methyl-5-prop-1-en-2-yl-1-[2-(trimethylsilylmethyl)prop-2-enyl]cyclohex-2-en-1-ol?
The InChIKey is CZLIYNZKZSPSTC-IAGOWNOFSA-N. The full InChI is InChI=1S/C17H30OSi/c1-13(2)16-9-8-15(4)17(18,11-16)10-14(3)12-19(5,6)7/h8,16,18H,1,3,9-12H2,2,4-7H3/t16-,17-/m1/s1.
What are the key properties of (1S,5R)-2-methyl-5-prop-1-en-2-yl-1-[2-(trimethylsilylmethyl)prop-2-enyl]cyclohex-2-en-1-ol?
(1S,5R)-2-methyl-5-prop-1-en-2-yl-1-[2-(trimethylsilylmethyl)prop-2-enyl]cyclohex-2-en-1-ol has a molecular weight of 278.51 g/mol, XLogP of 4.93, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1S,5R)-2-methyl-5-prop-1-en-2-yl-1-[2-(trimethylsilylmethyl)prop-2-enyl]cyclohex-2-en-1-ol is sourced from PubChem (CID 10707751), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).