N-[butyl-(diethylamino)-(dimethylamino)silyl]ethanamine

C12H31N3Si — CID 87334725

IUPACN-[butyl-(diethylamino)-(dimethylamino)silyl]ethanamine
SMILESCCCC[Si](NCC)(N(C)C)N(CC)CC
InChIInChI=1S/C12H31N3Si/c1-7-11-12-16(13-8-2,14(5)6)15(9-3)10-4/h13H,7-12H2,1-6H3
InChIKeyIJSGDPGBQFAWEY-UHFFFAOYSA-N
MW245.49 g/mol
LogP2.24
Rot. Bonds9

About N-[butyl-(diethylamino)-(dimethylamino)silyl]ethanamine

N-[butyl-(diethylamino)-(dimethylamino)silyl]ethanamine (PubChem CID 87334725) has the molecular formula C12H31N3Si and a molecular weight of 245.49 g/mol. Its IUPAC name is N-[butyl-(diethylamino)-(dimethylamino)silyl]ethanamine.

Molecular Properties

Compound NameN-[butyl-(diethylamino)-(dimethylamino)silyl]ethanamine
PubChem CID87334725
Molecular FormulaC12H31N3Si
Molecular Weight245.49 g/mol
Exact Mass245.23
IUPAC NameN-[butyl-(diethylamino)-(dimethylamino)silyl]ethanamine
SMILESCCCC[Si](NCC)(N(C)C)N(CC)CC
InChIInChI=1S/C12H31N3Si/c1-7-11-12-16(13-8-2,14(5)6)15(9-3)10-4/h13H,7-12H2,1-6H3
InChIKeyIJSGDPGBQFAWEY-UHFFFAOYSA-N
XLogP2.24
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.49
LogP ≤ 52.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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-(diethylamino)-(dimethylamino)silyl]ethanamine?
The IUPAC name of N-[butyl-(diethylamino)-(dimethylamino)silyl]ethanamine (CID 87334725) is N-[butyl-(diethylamino)-(dimethylamino)silyl]ethanamine.
What is the SMILES notation for N-[butyl-(diethylamino)-(dimethylamino)silyl]ethanamine?
The canonical SMILES for N-[butyl-(diethylamino)-(dimethylamino)silyl]ethanamine is CCCC[Si](NCC)(N(C)C)N(CC)CC.
What is the InChIKey of N-[butyl-(diethylamino)-(dimethylamino)silyl]ethanamine?
The InChIKey is IJSGDPGBQFAWEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H31N3Si/c1-7-11-12-16(13-8-2,14(5)6)15(9-3)10-4/h13H,7-12H2,1-6H3.
What are the key properties of N-[butyl-(diethylamino)-(dimethylamino)silyl]ethanamine?
N-[butyl-(diethylamino)-(dimethylamino)silyl]ethanamine has a molecular weight of 245.49 g/mol, XLogP of 2.24, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[butyl-(diethylamino)-(dimethylamino)silyl]ethanamine is sourced from PubChem (CID 87334725), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).