2-[(2Z)-2-[[tert-butyl(dimethyl)silyl]methylidene]cyclohexyl]acetic acid

C15H28O2Si — CID 67853854

IUPAC2-[(2Z)-2-[[tert-butyl(dimethyl)silyl]methylidene]cyclohexyl]acetic acid
SMILESCC(C)(C)[Si](C)(C)/C=C1/CCCCC1CC(=O)O
InChIInChI=1S/C15H28O2Si/c1-15(2,3)18(4,5)11-13-9-7-6-8-12(13)10-14(16)17/h11-12H,6-10H2,1-5H3,(H,16,17)/b13-11-
InChIKeyYROLYMVRYCMRGC-QBFSEMIESA-N
MW268.47 g/mol
LogP4.63
Rot. Bonds3

About 2-[(2Z)-2-[[tert-butyl(dimethyl)silyl]methylidene]cyclohexyl]acetic acid

2-[(2Z)-2-[[tert-butyl(dimethyl)silyl]methylidene]cyclohexyl]acetic acid (PubChem CID 67853854) has the molecular formula C15H28O2Si and a molecular weight of 268.47 g/mol. Its IUPAC name is 2-[(2Z)-2-[[tert-butyl(dimethyl)silyl]methylidene]cyclohexyl]acetic acid.

Molecular Properties

Compound Name2-[(2Z)-2-[[tert-butyl(dimethyl)silyl]methylidene]cyclohexyl]acetic acid
PubChem CID67853854
Molecular FormulaC15H28O2Si
Molecular Weight268.47 g/mol
Exact Mass268.19
IUPAC Name2-[(2Z)-2-[[tert-butyl(dimethyl)silyl]methylidene]cyclohexyl]acetic acid
SMILESCC(C)(C)[Si](C)(C)/C=C1/CCCCC1CC(=O)O
InChIInChI=1S/C15H28O2Si/c1-15(2,3)18(4,5)11-13-9-7-6-8-12(13)10-14(16)17/h11-12H,6-10H2,1-5H3,(H,16,17)/b13-11-
InChIKeyYROLYMVRYCMRGC-QBFSEMIESA-N
XLogP4.63
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.47
LogP ≤ 54.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze 2-[(2Z)-2-[[tert-butyl(dimethyl)silyl]methylidene]cyclohexyl]acetic acid 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 2-[(2Z)-2-[[tert-butyl(dimethyl)silyl]methylidene]cyclohexyl]acetic acid?
The IUPAC name of 2-[(2Z)-2-[[tert-butyl(dimethyl)silyl]methylidene]cyclohexyl]acetic acid (CID 67853854) is 2-[(2Z)-2-[[tert-butyl(dimethyl)silyl]methylidene]cyclohexyl]acetic acid.
What is the SMILES notation for 2-[(2Z)-2-[[tert-butyl(dimethyl)silyl]methylidene]cyclohexyl]acetic acid?
The canonical SMILES for 2-[(2Z)-2-[[tert-butyl(dimethyl)silyl]methylidene]cyclohexyl]acetic acid is CC(C)(C)[Si](C)(C)/C=C1/CCCCC1CC(=O)O.
What is the InChIKey of 2-[(2Z)-2-[[tert-butyl(dimethyl)silyl]methylidene]cyclohexyl]acetic acid?
The InChIKey is YROLYMVRYCMRGC-QBFSEMIESA-N. The full InChI is InChI=1S/C15H28O2Si/c1-15(2,3)18(4,5)11-13-9-7-6-8-12(13)10-14(16)17/h11-12H,6-10H2,1-5H3,(H,16,17)/b13-11-.
What are the key properties of 2-[(2Z)-2-[[tert-butyl(dimethyl)silyl]methylidene]cyclohexyl]acetic acid?
2-[(2Z)-2-[[tert-butyl(dimethyl)silyl]methylidene]cyclohexyl]acetic acid has a molecular weight of 268.47 g/mol, XLogP of 4.63, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2Z)-2-[[tert-butyl(dimethyl)silyl]methylidene]cyclohexyl]acetic acid is sourced from PubChem (CID 67853854), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).