N-(2-butan-2-yl-3-methylpent-1-enyl)silylethanamine

C12H27NSi — CID 154510134

IUPACN-(2-butan-2-yl-3-methylpent-1-enyl)silylethanamine
SMILESCCN[SiH2]C=C(C(C)CC)C(C)CC
InChIInChI=1S/C12H27NSi/c1-6-10(4)12(11(5)7-2)9-14-13-8-3/h9-11,13H,6-8,14H2,1-5H3
InChIKeyWTNWNZFSJRQBOI-UHFFFAOYSA-N
MW213.44 g/mol
LogP2.66
Rot. Bonds7

About N-(2-butan-2-yl-3-methylpent-1-enyl)silylethanamine

N-(2-butan-2-yl-3-methylpent-1-enyl)silylethanamine (PubChem CID 154510134) has the molecular formula C12H27NSi and a molecular weight of 213.44 g/mol. Its IUPAC name is N-(2-butan-2-yl-3-methylpent-1-enyl)silylethanamine.

Molecular Properties

Compound NameN-(2-butan-2-yl-3-methylpent-1-enyl)silylethanamine
PubChem CID154510134
Molecular FormulaC12H27NSi
Molecular Weight213.44 g/mol
Exact Mass213.19
IUPAC NameN-(2-butan-2-yl-3-methylpent-1-enyl)silylethanamine
SMILESCCN[SiH2]C=C(C(C)CC)C(C)CC
InChIInChI=1S/C12H27NSi/c1-6-10(4)12(11(5)7-2)9-14-13-8-3/h9-11,13H,6-8,14H2,1-5H3
InChIKeyWTNWNZFSJRQBOI-UHFFFAOYSA-N
XLogP2.66
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.44
LogP ≤ 52.66
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-butan-2-yl-3-methylpent-1-enyl)silylethanamine?
The IUPAC name of N-(2-butan-2-yl-3-methylpent-1-enyl)silylethanamine (CID 154510134) is N-(2-butan-2-yl-3-methylpent-1-enyl)silylethanamine.
What is the SMILES notation for N-(2-butan-2-yl-3-methylpent-1-enyl)silylethanamine?
The canonical SMILES for N-(2-butan-2-yl-3-methylpent-1-enyl)silylethanamine is CCN[SiH2]C=C(C(C)CC)C(C)CC.
What is the InChIKey of N-(2-butan-2-yl-3-methylpent-1-enyl)silylethanamine?
The InChIKey is WTNWNZFSJRQBOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H27NSi/c1-6-10(4)12(11(5)7-2)9-14-13-8-3/h9-11,13H,6-8,14H2,1-5H3.
What are the key properties of N-(2-butan-2-yl-3-methylpent-1-enyl)silylethanamine?
N-(2-butan-2-yl-3-methylpent-1-enyl)silylethanamine has a molecular weight of 213.44 g/mol, XLogP of 2.66, 7 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-butan-2-yl-3-methylpent-1-enyl)silylethanamine is sourced from PubChem (CID 154510134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).