CID 68585082

C11H16OSi — CID 68585082

IUPAC—
SMILESCCCC[Si]Oc1ccccc1C
InChIInChI=1S/C11H16OSi/c1-3-4-9-13-12-11-8-6-5-7-10(11)2/h5-8H,3-4,9H2,1-2H3
InChIKeyKLVORZNMJKKLCN-UHFFFAOYSA-N
MW192.33 g/mol
LogP3.21
Rot. Bonds5

About CID 68585082

CID 68585082 (PubChem CID 68585082) has the molecular formula C11H16OSi and a molecular weight of 192.33 g/mol.

Molecular Properties

Compound NameCID 68585082
PubChem CID68585082
Molecular FormulaC11H16OSi
Molecular Weight192.33 g/mol
Exact Mass192.10
IUPAC Name—
SMILESCCCC[Si]Oc1ccccc1C
InChIInChI=1S/C11H16OSi/c1-3-4-9-13-12-11-8-6-5-7-10(11)2/h5-8H,3-4,9H2,1-2H3
InChIKeyKLVORZNMJKKLCN-UHFFFAOYSA-N
XLogP3.21
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.33
LogP ≤ 53.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze CID 68585082 with MolForge

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

Launch Full Analysis

Related Compounds

ethane;1-methyl-2-pentoxybenzene
CID 143283195
1-methyl-2-pentadecoxybenzene
CID 154641785
tris(1-methoxy-2-methylbenzene);propane
CID 158759517
tetrakis(hexane);tris(1,2-xylene)
CID 173431292
2-butyl-1,3-dimethoxybenzene
CID 524840
2-butyl-1-(2-butyl-3-methylphenoxy)-3-methylbenzene
CID 175265756
1-(2-methylphenoxy)butylphosphane
CID 175049476
butane;ethane;3-ethylpentane;octakis(1-methoxy-2-methylbenzene);3-methylpentane;pentane
CID 159679469
butyl-tris(2-methylphenoxy)-phenyl-λ5-phosphane
CID 174625067
1-[butyl(ethyl)phosphoryl]oxy-2-methylbenzene
CID 23081741
1-henicos-1-enoxy-2-methylbenzene
CID 156783878
N-[2-(2-methylphenoxy)ethyl]pentan-1-amine
CID 60684172

Frequently Asked Questions

What is the IUPAC name of CID 68585082?
The IUPAC name of CID 68585082 (CID 68585082) is not available.
What is the SMILES notation for CID 68585082?
The canonical SMILES for CID 68585082 is CCCC[Si]Oc1ccccc1C.
What is the InChIKey of CID 68585082?
The InChIKey is KLVORZNMJKKLCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16OSi/c1-3-4-9-13-12-11-8-6-5-7-10(11)2/h5-8H,3-4,9H2,1-2H3.
What are the key properties of CID 68585082?
CID 68585082 has a molecular weight of 192.33 g/mol, XLogP of 3.21, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 68585082 is sourced from PubChem (CID 68585082), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).