N-[2-[tert-butyl(dimethyl)silyl]ethyl]butan-1-amine

C12H29NSi — CID 101135290

IUPACN-[2-[tert-butyl(dimethyl)silyl]ethyl]butan-1-amine
SMILESCCCCNCC[Si](C)(C)C(C)(C)C
InChIInChI=1S/C12H29NSi/c1-7-8-9-13-10-11-14(5,6)12(2,3)4/h13H,7-11H2,1-6H3
InChIKeyCWPFFGKRFZDWRG-UHFFFAOYSA-N
MW215.46 g/mol
LogP3.88
Rot. Bonds6

About N-[2-[tert-butyl(dimethyl)silyl]ethyl]butan-1-amine

N-[2-[tert-butyl(dimethyl)silyl]ethyl]butan-1-amine (PubChem CID 101135290) has the molecular formula C12H29NSi and a molecular weight of 215.46 g/mol. Its IUPAC name is N-[2-[tert-butyl(dimethyl)silyl]ethyl]butan-1-amine.

Molecular Properties

Compound NameN-[2-[tert-butyl(dimethyl)silyl]ethyl]butan-1-amine
PubChem CID101135290
Molecular FormulaC12H29NSi
Molecular Weight215.46 g/mol
Exact Mass215.21
IUPAC NameN-[2-[tert-butyl(dimethyl)silyl]ethyl]butan-1-amine
SMILESCCCCNCC[Si](C)(C)C(C)(C)C
InChIInChI=1S/C12H29NSi/c1-7-8-9-13-10-11-14(5,6)12(2,3)4/h13H,7-11H2,1-6H3
InChIKeyCWPFFGKRFZDWRG-UHFFFAOYSA-N
XLogP3.88
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.46
LogP ≤ 53.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-[2-[tert-butyl(dimethyl)silyl]ethyl]butan-1-amine?
The IUPAC name of N-[2-[tert-butyl(dimethyl)silyl]ethyl]butan-1-amine (CID 101135290) is N-[2-[tert-butyl(dimethyl)silyl]ethyl]butan-1-amine.
What is the SMILES notation for N-[2-[tert-butyl(dimethyl)silyl]ethyl]butan-1-amine?
The canonical SMILES for N-[2-[tert-butyl(dimethyl)silyl]ethyl]butan-1-amine is CCCCNCC[Si](C)(C)C(C)(C)C.
What is the InChIKey of N-[2-[tert-butyl(dimethyl)silyl]ethyl]butan-1-amine?
The InChIKey is CWPFFGKRFZDWRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H29NSi/c1-7-8-9-13-10-11-14(5,6)12(2,3)4/h13H,7-11H2,1-6H3.
What are the key properties of N-[2-[tert-butyl(dimethyl)silyl]ethyl]butan-1-amine?
N-[2-[tert-butyl(dimethyl)silyl]ethyl]butan-1-amine has a molecular weight of 215.46 g/mol, XLogP of 3.88, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[tert-butyl(dimethyl)silyl]ethyl]butan-1-amine is sourced from PubChem (CID 101135290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).