N-[tert-butyl(dimethoxy)silyl]-1-cyclohexylmethanamine

C13H29NO2Si — CID 139658459

IUPACN-[tert-butyl(dimethoxy)silyl]-1-cyclohexylmethanamine
SMILESCO[Si](NCC1CCCCC1)(OC)C(C)(C)C
InChIInChI=1S/C13H29NO2Si/c1-13(2,3)17(15-4,16-5)14-11-12-9-7-6-8-10-12/h12,14H,6-11H2,1-5H3
InChIKeyHNTBAUQZMSYVIA-UHFFFAOYSA-N
MW259.47 g/mol
LogP3.19
Rot. Bonds5

About N-[tert-butyl(dimethoxy)silyl]-1-cyclohexylmethanamine

N-[tert-butyl(dimethoxy)silyl]-1-cyclohexylmethanamine (PubChem CID 139658459) has the molecular formula C13H29NO2Si and a molecular weight of 259.47 g/mol. Its IUPAC name is N-[tert-butyl(dimethoxy)silyl]-1-cyclohexylmethanamine.

Molecular Properties

Compound NameN-[tert-butyl(dimethoxy)silyl]-1-cyclohexylmethanamine
PubChem CID139658459
Molecular FormulaC13H29NO2Si
Molecular Weight259.47 g/mol
Exact Mass259.20
IUPAC NameN-[tert-butyl(dimethoxy)silyl]-1-cyclohexylmethanamine
SMILESCO[Si](NCC1CCCCC1)(OC)C(C)(C)C
InChIInChI=1S/C13H29NO2Si/c1-13(2,3)17(15-4,16-5)14-11-12-9-7-6-8-10-12/h12,14H,6-11H2,1-5H3
InChIKeyHNTBAUQZMSYVIA-UHFFFAOYSA-N
XLogP3.19
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.47
LogP ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze N-[tert-butyl(dimethoxy)silyl]-1-cyclohexylmethanamine 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 N-[tert-butyl(dimethoxy)silyl]-1-cyclohexylmethanamine?
The IUPAC name of N-[tert-butyl(dimethoxy)silyl]-1-cyclohexylmethanamine (CID 139658459) is N-[tert-butyl(dimethoxy)silyl]-1-cyclohexylmethanamine.
What is the SMILES notation for N-[tert-butyl(dimethoxy)silyl]-1-cyclohexylmethanamine?
The canonical SMILES for N-[tert-butyl(dimethoxy)silyl]-1-cyclohexylmethanamine is CO[Si](NCC1CCCCC1)(OC)C(C)(C)C.
What is the InChIKey of N-[tert-butyl(dimethoxy)silyl]-1-cyclohexylmethanamine?
The InChIKey is HNTBAUQZMSYVIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H29NO2Si/c1-13(2,3)17(15-4,16-5)14-11-12-9-7-6-8-10-12/h12,14H,6-11H2,1-5H3.
What are the key properties of N-[tert-butyl(dimethoxy)silyl]-1-cyclohexylmethanamine?
N-[tert-butyl(dimethoxy)silyl]-1-cyclohexylmethanamine has a molecular weight of 259.47 g/mol, XLogP of 3.19, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[tert-butyl(dimethoxy)silyl]-1-cyclohexylmethanamine is sourced from PubChem (CID 139658459), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).