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

C13H31NSi — CID 106323158

IUPAC3-methyl-N-(2-methylpropyl)-2-(trimethylsilylmethyl)butan-1-amine
SMILESCC(C)CNCC(C[Si](C)(C)C)C(C)C
InChIInChI=1S/C13H31NSi/c1-11(2)8-14-9-13(12(3)4)10-15(5,6)7/h11-14H,8-10H2,1-7H3
InChIKeyBCYMBFCLCZPHKB-UHFFFAOYSA-N
MW229.48 g/mol
LogP3.84
Rot. Bonds7

About 3-methyl-N-(2-methylpropyl)-2-(trimethylsilylmethyl)butan-1-amine

3-methyl-N-(2-methylpropyl)-2-(trimethylsilylmethyl)butan-1-amine (PubChem CID 106323158) has the molecular formula C13H31NSi and a molecular weight of 229.48 g/mol. Its IUPAC name is 3-methyl-N-(2-methylpropyl)-2-(trimethylsilylmethyl)butan-1-amine.

Molecular Properties

Compound Name3-methyl-N-(2-methylpropyl)-2-(trimethylsilylmethyl)butan-1-amine
PubChem CID106323158
Molecular FormulaC13H31NSi
Molecular Weight229.48 g/mol
Exact Mass229.22
IUPAC Name3-methyl-N-(2-methylpropyl)-2-(trimethylsilylmethyl)butan-1-amine
SMILESCC(C)CNCC(C[Si](C)(C)C)C(C)C
InChIInChI=1S/C13H31NSi/c1-11(2)8-14-9-13(12(3)4)10-15(5,6)7/h11-14H,8-10H2,1-7H3
InChIKeyBCYMBFCLCZPHKB-UHFFFAOYSA-N
XLogP3.84
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.48
LogP ≤ 53.84
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 3-methyl-N-(2-methylpropyl)-2-(trimethylsilylmethyl)butan-1-amine?
The IUPAC name of 3-methyl-N-(2-methylpropyl)-2-(trimethylsilylmethyl)butan-1-amine (CID 106323158) is 3-methyl-N-(2-methylpropyl)-2-(trimethylsilylmethyl)butan-1-amine.
What is the SMILES notation for 3-methyl-N-(2-methylpropyl)-2-(trimethylsilylmethyl)butan-1-amine?
The canonical SMILES for 3-methyl-N-(2-methylpropyl)-2-(trimethylsilylmethyl)butan-1-amine is CC(C)CNCC(C[Si](C)(C)C)C(C)C.
What is the InChIKey of 3-methyl-N-(2-methylpropyl)-2-(trimethylsilylmethyl)butan-1-amine?
The InChIKey is BCYMBFCLCZPHKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H31NSi/c1-11(2)8-14-9-13(12(3)4)10-15(5,6)7/h11-14H,8-10H2,1-7H3.
What are the key properties of 3-methyl-N-(2-methylpropyl)-2-(trimethylsilylmethyl)butan-1-amine?
3-methyl-N-(2-methylpropyl)-2-(trimethylsilylmethyl)butan-1-amine has a molecular weight of 229.48 g/mol, XLogP of 3.84, 7 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-(2-methylpropyl)-2-(trimethylsilylmethyl)butan-1-amine is sourced from PubChem (CID 106323158), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).