N-butyl-N-(2-trimethylsilyloxyethyl)butan-1-amine

C13H31NOSi — CID 28215

IUPACN-butyl-N-(2-trimethylsilyloxyethyl)butan-1-amine
SMILESCCCCN(CCCC)CCO[Si](C)(C)C
InChIInChI=1S/C13H31NOSi/c1-6-8-10-14(11-9-7-2)12-13-15-16(3,4)5/h6-13H2,1-5H3
InChIKeyKJLJXWIGJMLONY-UHFFFAOYSA-N
MW245.48 g/mol
LogP3.74
Rot. Bonds10

About N-butyl-N-(2-trimethylsilyloxyethyl)butan-1-amine

N-butyl-N-(2-trimethylsilyloxyethyl)butan-1-amine (PubChem CID 28215) has the molecular formula C13H31NOSi and a molecular weight of 245.48 g/mol. Its IUPAC name is N-butyl-N-(2-trimethylsilyloxyethyl)butan-1-amine.

Molecular Properties

Compound NameN-butyl-N-(2-trimethylsilyloxyethyl)butan-1-amine
PubChem CID28215
Molecular FormulaC13H31NOSi
Molecular Weight245.48 g/mol
Exact Mass245.22
IUPAC NameN-butyl-N-(2-trimethylsilyloxyethyl)butan-1-amine
SMILESCCCCN(CCCC)CCO[Si](C)(C)C
InChIInChI=1S/C13H31NOSi/c1-6-8-10-14(11-9-7-2)12-13-15-16(3,4)5/h6-13H2,1-5H3
InChIKeyKJLJXWIGJMLONY-UHFFFAOYSA-N
XLogP3.74
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.48
LogP ≤ 53.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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-butyl-N-(2-trimethylsilyloxyethyl)butan-1-amine?
The IUPAC name of N-butyl-N-(2-trimethylsilyloxyethyl)butan-1-amine (CID 28215) is N-butyl-N-(2-trimethylsilyloxyethyl)butan-1-amine.
What is the SMILES notation for N-butyl-N-(2-trimethylsilyloxyethyl)butan-1-amine?
The canonical SMILES for N-butyl-N-(2-trimethylsilyloxyethyl)butan-1-amine is CCCCN(CCCC)CCO[Si](C)(C)C.
What is the InChIKey of N-butyl-N-(2-trimethylsilyloxyethyl)butan-1-amine?
The InChIKey is KJLJXWIGJMLONY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H31NOSi/c1-6-8-10-14(11-9-7-2)12-13-15-16(3,4)5/h6-13H2,1-5H3.
What are the key properties of N-butyl-N-(2-trimethylsilyloxyethyl)butan-1-amine?
N-butyl-N-(2-trimethylsilyloxyethyl)butan-1-amine has a molecular weight of 245.48 g/mol, XLogP of 3.74, 10 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-butyl-N-(2-trimethylsilyloxyethyl)butan-1-amine is sourced from PubChem (CID 28215), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).