N-(2-methylpropyl)-2-(trimethylsilylmethyl)butan-1-amine

C12H29NSi — CID 106323167

IUPACN-(2-methylpropyl)-2-(trimethylsilylmethyl)butan-1-amine
SMILESCCC(CNCC(C)C)C[Si](C)(C)C
InChIInChI=1S/C12H29NSi/c1-7-12(10-14(4,5)6)9-13-8-11(2)3/h11-13H,7-10H2,1-6H3
InChIKeyPLFTXTOEABBQOZ-UHFFFAOYSA-N
MW215.46 g/mol
LogP3.60
Rot. Bonds7

About N-(2-methylpropyl)-2-(trimethylsilylmethyl)butan-1-amine

N-(2-methylpropyl)-2-(trimethylsilylmethyl)butan-1-amine (PubChem CID 106323167) has the molecular formula C12H29NSi and a molecular weight of 215.46 g/mol. Its IUPAC name is N-(2-methylpropyl)-2-(trimethylsilylmethyl)butan-1-amine.

Molecular Properties

Compound NameN-(2-methylpropyl)-2-(trimethylsilylmethyl)butan-1-amine
PubChem CID106323167
Molecular FormulaC12H29NSi
Molecular Weight215.46 g/mol
Exact Mass215.21
IUPAC NameN-(2-methylpropyl)-2-(trimethylsilylmethyl)butan-1-amine
SMILESCCC(CNCC(C)C)C[Si](C)(C)C
InChIInChI=1S/C12H29NSi/c1-7-12(10-14(4,5)6)9-13-8-11(2)3/h11-13H,7-10H2,1-6H3
InChIKeyPLFTXTOEABBQOZ-UHFFFAOYSA-N
XLogP3.60
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.46
LogP ≤ 53.60
H-Bond Donors ≤ 51
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-(2-methylpropyl)-2-(trimethylsilylmethyl)butan-1-amine?
The IUPAC name of N-(2-methylpropyl)-2-(trimethylsilylmethyl)butan-1-amine (CID 106323167) is N-(2-methylpropyl)-2-(trimethylsilylmethyl)butan-1-amine.
What is the SMILES notation for N-(2-methylpropyl)-2-(trimethylsilylmethyl)butan-1-amine?
The canonical SMILES for N-(2-methylpropyl)-2-(trimethylsilylmethyl)butan-1-amine is CCC(CNCC(C)C)C[Si](C)(C)C.
What is the InChIKey of N-(2-methylpropyl)-2-(trimethylsilylmethyl)butan-1-amine?
The InChIKey is PLFTXTOEABBQOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H29NSi/c1-7-12(10-14(4,5)6)9-13-8-11(2)3/h11-13H,7-10H2,1-6H3.
What are the key properties of N-(2-methylpropyl)-2-(trimethylsilylmethyl)butan-1-amine?
N-(2-methylpropyl)-2-(trimethylsilylmethyl)butan-1-amine has a molecular weight of 215.46 g/mol, XLogP of 3.60, 7 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylpropyl)-2-(trimethylsilylmethyl)butan-1-amine is sourced from PubChem (CID 106323167), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).