N,N-bis[tert-butyl(dimethyl)silyl]-1-(4-ethenylphenyl)methanamine

C21H39NSi2 — CID 66742780

IUPACN,N-bis[tert-butyl(dimethyl)silyl]-1-(4-ethenylphenyl)methanamine
SMILESC=Cc1ccc(CN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)cc1
InChIInChI=1S/C21H39NSi2/c1-12-18-13-15-19(16-14-18)17-22(23(8,9)20(2,3)4)24(10,11)21(5,6)7/h12-16H,1,17H2,2-11H3
InChIKeyJUHVHDDBVZNXFP-UHFFFAOYSA-N
MW361.72 g/mol
LogP7.14
Rot. Bonds5

About N,N-bis[tert-butyl(dimethyl)silyl]-1-(4-ethenylphenyl)methanamine

N,N-bis[tert-butyl(dimethyl)silyl]-1-(4-ethenylphenyl)methanamine (PubChem CID 66742780) has the molecular formula C21H39NSi2 and a molecular weight of 361.72 g/mol. Its IUPAC name is N,N-bis[tert-butyl(dimethyl)silyl]-1-(4-ethenylphenyl)methanamine.

Molecular Properties

Compound NameN,N-bis[tert-butyl(dimethyl)silyl]-1-(4-ethenylphenyl)methanamine
PubChem CID66742780
Molecular FormulaC21H39NSi2
Molecular Weight361.72 g/mol
Exact Mass361.26
IUPAC NameN,N-bis[tert-butyl(dimethyl)silyl]-1-(4-ethenylphenyl)methanamine
SMILESC=Cc1ccc(CN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)cc1
InChIInChI=1S/C21H39NSi2/c1-12-18-13-15-19(16-14-18)17-22(23(8,9)20(2,3)4)24(10,11)21(5,6)7/h12-16H,1,17H2,2-11H3
InChIKeyJUHVHDDBVZNXFP-UHFFFAOYSA-N
XLogP7.14
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500361.72
LogP ≤ 57.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N,N-bis[tert-butyl(dimethyl)silyl]-1-(4-ethenylphenyl)methanamine?
The IUPAC name of N,N-bis[tert-butyl(dimethyl)silyl]-1-(4-ethenylphenyl)methanamine (CID 66742780) is N,N-bis[tert-butyl(dimethyl)silyl]-1-(4-ethenylphenyl)methanamine.
What is the SMILES notation for N,N-bis[tert-butyl(dimethyl)silyl]-1-(4-ethenylphenyl)methanamine?
The canonical SMILES for N,N-bis[tert-butyl(dimethyl)silyl]-1-(4-ethenylphenyl)methanamine is C=Cc1ccc(CN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)cc1.
What is the InChIKey of N,N-bis[tert-butyl(dimethyl)silyl]-1-(4-ethenylphenyl)methanamine?
The InChIKey is JUHVHDDBVZNXFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H39NSi2/c1-12-18-13-15-19(16-14-18)17-22(23(8,9)20(2,3)4)24(10,11)21(5,6)7/h12-16H,1,17H2,2-11H3.
What are the key properties of N,N-bis[tert-butyl(dimethyl)silyl]-1-(4-ethenylphenyl)methanamine?
N,N-bis[tert-butyl(dimethyl)silyl]-1-(4-ethenylphenyl)methanamine has a molecular weight of 361.72 g/mol, XLogP of 7.14, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-bis[tert-butyl(dimethyl)silyl]-1-(4-ethenylphenyl)methanamine is sourced from PubChem (CID 66742780), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).