cis-(1S,2R)-2-[2-(trimethylsilylmethyl)prop-2-enyl]cyclohexan-1-ol

C13H26OSi — CID 15263617

IUPACcis-(1S,2R)-2-[2-(trimethylsilylmethyl)prop-2-enyl]cyclohexan-1-ol
SMILESC=C(C[C@H]1CCCC[C@@H]1O)C[Si](C)(C)C
InChIInChI=1S/C13H26OSi/c1-11(10-15(2,3)4)9-12-7-5-6-8-13(12)14/h12-14H,1,5-10H2,2-4H3/t12-,13+/m1/s1
InChIKeyMQMBAMDSGJLLRB-OLZOCXBDSA-N
MW226.44 g/mol
LogP3.82
Rot. Bonds4

About cis-(1S,2R)-2-[2-(trimethylsilylmethyl)prop-2-enyl]cyclohexan-1-ol

cis-(1S,2R)-2-[2-(trimethylsilylmethyl)prop-2-enyl]cyclohexan-1-ol (PubChem CID 15263617) has the molecular formula C13H26OSi and a molecular weight of 226.44 g/mol. Its IUPAC name is cis-(1S,2R)-2-[2-(trimethylsilylmethyl)prop-2-enyl]cyclohexan-1-ol.

Molecular Properties

Compound Namecis-(1S,2R)-2-[2-(trimethylsilylmethyl)prop-2-enyl]cyclohexan-1-ol
PubChem CID15263617
Molecular FormulaC13H26OSi
Molecular Weight226.44 g/mol
Exact Mass226.18
IUPAC Namecis-(1S,2R)-2-[2-(trimethylsilylmethyl)prop-2-enyl]cyclohexan-1-ol
SMILESC=C(C[C@H]1CCCC[C@@H]1O)C[Si](C)(C)C
InChIInChI=1S/C13H26OSi/c1-11(10-15(2,3)4)9-12-7-5-6-8-13(12)14/h12-14H,1,5-10H2,2-4H3/t12-,13+/m1/s1
InChIKeyMQMBAMDSGJLLRB-OLZOCXBDSA-N
XLogP3.82
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.44
LogP ≤ 53.82
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 cis-(1S,2R)-2-[2-(trimethylsilylmethyl)prop-2-enyl]cyclohexan-1-ol with MolForge

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Related Compounds

o-Mentha-1(7),8-dien-3-ol
CID 564552
3-Methylidene-2-propan-2-ylcyclohexan-1-ol
CID 130149091
Cyclohexanemethanol, alpha-(2-methylallyl)-
CID 565338
(Z)-4-[tert-butyl(dimethyl)silyl]oxy-1-cyclohexyl-3-(trimethylsilylmethyl)but-3-en-1-ol
CID 11291668
(E)-1-cyclohexyl-4-trimethylsilylbut-3-en-1-ol
CID 12022452
1-Cyclohexyl-2-tri(propan-2-yl)silylbuta-2,3-dien-1-ol
CID 101261971
trans-(1S,2R)-2-prop-1-en-2-ylcyclohexan-1-ol
CID 11137247
1-Cyclohexyl-2-trimethylsilylbuta-2,3-dien-1-ol
CID 11138784
cis-(1S,2S)-2-prop-1-en-2-ylcyclohexan-1-ol
CID 12511049
2-(Prop-1-en-2-yl)cyclohexan-1-ol
CID 12511050
4-(2-Methylprop-2-enyl)cyclohexan-1-ol
CID 57052055
trans-(1R,2S)-5-methylidene-2-propan-2-ylcyclohexan-1-ol
CID 135054853

Frequently Asked Questions

What is the IUPAC name of cis-(1S,2R)-2-[2-(trimethylsilylmethyl)prop-2-enyl]cyclohexan-1-ol?
The IUPAC name of cis-(1S,2R)-2-[2-(trimethylsilylmethyl)prop-2-enyl]cyclohexan-1-ol (CID 15263617) is cis-(1S,2R)-2-[2-(trimethylsilylmethyl)prop-2-enyl]cyclohexan-1-ol.
What is the SMILES notation for cis-(1S,2R)-2-[2-(trimethylsilylmethyl)prop-2-enyl]cyclohexan-1-ol?
The canonical SMILES for cis-(1S,2R)-2-[2-(trimethylsilylmethyl)prop-2-enyl]cyclohexan-1-ol is C=C(C[C@H]1CCCC[C@@H]1O)C[Si](C)(C)C.
What is the InChIKey of cis-(1S,2R)-2-[2-(trimethylsilylmethyl)prop-2-enyl]cyclohexan-1-ol?
The InChIKey is MQMBAMDSGJLLRB-OLZOCXBDSA-N. The full InChI is InChI=1S/C13H26OSi/c1-11(10-15(2,3)4)9-12-7-5-6-8-13(12)14/h12-14H,1,5-10H2,2-4H3/t12-,13+/m1/s1.
What are the key properties of cis-(1S,2R)-2-[2-(trimethylsilylmethyl)prop-2-enyl]cyclohexan-1-ol?
cis-(1S,2R)-2-[2-(trimethylsilylmethyl)prop-2-enyl]cyclohexan-1-ol has a molecular weight of 226.44 g/mol, XLogP of 3.82, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for cis-(1S,2R)-2-[2-(trimethylsilylmethyl)prop-2-enyl]cyclohexan-1-ol is sourced from PubChem (CID 15263617), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).