4-[tert-butyl(diphenyl)silyl]oxycyclohexan-1-amine

C22H31NOSi — CID 71222982

IUPAC4-[tert-butyl(diphenyl)silyl]oxycyclohexan-1-amine
SMILESCC(C)(C)[Si](OC1CCC(N)CC1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C22H31NOSi/c1-22(2,3)25(20-10-6-4-7-11-20,21-12-8-5-9-13-21)24-19-16-14-18(23)15-17-19/h4-13,18-19H,14-17,23H2,1-3H3
InChIKeyCHRNWFDNASYVLH-UHFFFAOYSA-N
MW353.58 g/mol
LogP3.83
Rot. Bonds4

About 4-[tert-butyl(diphenyl)silyl]oxycyclohexan-1-amine

4-[tert-butyl(diphenyl)silyl]oxycyclohexan-1-amine (PubChem CID 71222982) has the molecular formula C22H31NOSi and a molecular weight of 353.58 g/mol. Its IUPAC name is 4-[tert-butyl(diphenyl)silyl]oxycyclohexan-1-amine.

Molecular Properties

Compound Name4-[tert-butyl(diphenyl)silyl]oxycyclohexan-1-amine
PubChem CID71222982
Molecular FormulaC22H31NOSi
Molecular Weight353.58 g/mol
Exact Mass353.22
IUPAC Name4-[tert-butyl(diphenyl)silyl]oxycyclohexan-1-amine
SMILESCC(C)(C)[Si](OC1CCC(N)CC1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C22H31NOSi/c1-22(2,3)25(20-10-6-4-7-11-20,21-12-8-5-9-13-21)24-19-16-14-18(23)15-17-19/h4-13,18-19H,14-17,23H2,1-3H3
InChIKeyCHRNWFDNASYVLH-UHFFFAOYSA-N
XLogP3.83
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.58
LogP ≤ 53.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 4-[tert-butyl(diphenyl)silyl]oxycyclohexan-1-amine 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 4-[tert-butyl(diphenyl)silyl]oxycyclohexan-1-amine?
The IUPAC name of 4-[tert-butyl(diphenyl)silyl]oxycyclohexan-1-amine (CID 71222982) is 4-[tert-butyl(diphenyl)silyl]oxycyclohexan-1-amine.
What is the SMILES notation for 4-[tert-butyl(diphenyl)silyl]oxycyclohexan-1-amine?
The canonical SMILES for 4-[tert-butyl(diphenyl)silyl]oxycyclohexan-1-amine is CC(C)(C)[Si](OC1CCC(N)CC1)(c1ccccc1)c1ccccc1.
What is the InChIKey of 4-[tert-butyl(diphenyl)silyl]oxycyclohexan-1-amine?
The InChIKey is CHRNWFDNASYVLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H31NOSi/c1-22(2,3)25(20-10-6-4-7-11-20,21-12-8-5-9-13-21)24-19-16-14-18(23)15-17-19/h4-13,18-19H,14-17,23H2,1-3H3.
What are the key properties of 4-[tert-butyl(diphenyl)silyl]oxycyclohexan-1-amine?
4-[tert-butyl(diphenyl)silyl]oxycyclohexan-1-amine has a molecular weight of 353.58 g/mol, XLogP of 3.83, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[tert-butyl(diphenyl)silyl]oxycyclohexan-1-amine is sourced from PubChem (CID 71222982), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).