(2-cyclohexyl-1,1-dimethoxyethoxy)-dimethoxy-naphthalen-1-ylsilane

C22H32O5Si — CID 154021156

IUPAC(2-cyclohexyl-1,1-dimethoxyethoxy)-dimethoxy-naphthalen-1-ylsilane
SMILESCOC(CC1CCCCC1)(OC)O[Si](OC)(OC)c1cccc2ccccc12
InChIInChI=1S/C22H32O5Si/c1-23-22(24-2,17-18-11-6-5-7-12-18)27-28(25-3,26-4)21-16-10-14-19-13-8-9-15-20(19)21/h8-10,13-16,18H,5-7,11-12,17H2,1-4H3
InChIKeyUQVLMNYZOCDLOU-UHFFFAOYSA-N
MW404.58 g/mol
LogP4.21
Rot. Bonds9

About (2-cyclohexyl-1,1-dimethoxyethoxy)-dimethoxy-naphthalen-1-ylsilane

(2-cyclohexyl-1,1-dimethoxyethoxy)-dimethoxy-naphthalen-1-ylsilane (PubChem CID 154021156) has the molecular formula C22H32O5Si and a molecular weight of 404.58 g/mol. Its IUPAC name is (2-cyclohexyl-1,1-dimethoxyethoxy)-dimethoxy-naphthalen-1-ylsilane.

Molecular Properties

Compound Name(2-cyclohexyl-1,1-dimethoxyethoxy)-dimethoxy-naphthalen-1-ylsilane
PubChem CID154021156
Molecular FormulaC22H32O5Si
Molecular Weight404.58 g/mol
Exact Mass404.20
IUPAC Name(2-cyclohexyl-1,1-dimethoxyethoxy)-dimethoxy-naphthalen-1-ylsilane
SMILESCOC(CC1CCCCC1)(OC)O[Si](OC)(OC)c1cccc2ccccc12
InChIInChI=1S/C22H32O5Si/c1-23-22(24-2,17-18-11-6-5-7-12-18)27-28(25-3,26-4)21-16-10-14-19-13-8-9-15-20(19)21/h8-10,13-16,18H,5-7,11-12,17H2,1-4H3
InChIKeyUQVLMNYZOCDLOU-UHFFFAOYSA-N
XLogP4.21
TPSA46.15 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500404.58
LogP ≤ 54.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

Analyze (2-cyclohexyl-1,1-dimethoxyethoxy)-dimethoxy-naphthalen-1-ylsilane 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

methoxy-naphthalen-1-yl-dipropoxysilane
CID 140892673
cyclohexyl-[4-(cyclohexylmethoxy)naphthalen-1-yl]-methyl-naphthalen-1-ylsilane
CID 144518056
cyclohexylmethyl(naphthalen-1-yl)phosphane
CID 167150287
anthracen-1-yl-(bromomethoxy)-dimethoxysilane
CID 87375026
1-cyclohexyl-N-[(2-methoxynaphthalen-1-yl)methyl]methanamine
CID 43215559
anthracen-1-yl-methoxy-dimethylsilane
CID 141440937
1-(cyclononylmethyl)anthracene
CID 173272600
9-(cycloheptylmethyl)anthracene
CID 173272889
9-(cyclohexylmethyl)anthracene
CID 173272896
2-(naphthalen-1-ylmethoxy)oxane
CID 15471078
(3-cyclohexyl-1-naphthalen-1-ylpropyl)hydrazine
CID 105301235
[4-(cyclohexanecarbonyloxy)-2,3-dimethoxynaphthalen-1-yl] cyclohexanecarboxylate
CID 19886717

Frequently Asked Questions

What is the IUPAC name of (2-cyclohexyl-1,1-dimethoxyethoxy)-dimethoxy-naphthalen-1-ylsilane?
The IUPAC name of (2-cyclohexyl-1,1-dimethoxyethoxy)-dimethoxy-naphthalen-1-ylsilane (CID 154021156) is (2-cyclohexyl-1,1-dimethoxyethoxy)-dimethoxy-naphthalen-1-ylsilane.
What is the SMILES notation for (2-cyclohexyl-1,1-dimethoxyethoxy)-dimethoxy-naphthalen-1-ylsilane?
The canonical SMILES for (2-cyclohexyl-1,1-dimethoxyethoxy)-dimethoxy-naphthalen-1-ylsilane is COC(CC1CCCCC1)(OC)O[Si](OC)(OC)c1cccc2ccccc12.
What is the InChIKey of (2-cyclohexyl-1,1-dimethoxyethoxy)-dimethoxy-naphthalen-1-ylsilane?
The InChIKey is UQVLMNYZOCDLOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H32O5Si/c1-23-22(24-2,17-18-11-6-5-7-12-18)27-28(25-3,26-4)21-16-10-14-19-13-8-9-15-20(19)21/h8-10,13-16,18H,5-7,11-12,17H2,1-4H3.
What are the key properties of (2-cyclohexyl-1,1-dimethoxyethoxy)-dimethoxy-naphthalen-1-ylsilane?
(2-cyclohexyl-1,1-dimethoxyethoxy)-dimethoxy-naphthalen-1-ylsilane has a molecular weight of 404.58 g/mol, XLogP of 4.21, 9 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2-cyclohexyl-1,1-dimethoxyethoxy)-dimethoxy-naphthalen-1-ylsilane is sourced from PubChem (CID 154021156), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).