N-[tert-butyl-chloro-(ethylamino)silyl]ethanamine

C8H21ClN2Si — CID 87334352

IUPACN-[tert-butyl-chloro-(ethylamino)silyl]ethanamine
SMILESCCN[Si](Cl)(NCC)C(C)(C)C
InChIInChI=1S/C8H21ClN2Si/c1-6-10-12(9,11-7-2)8(3,4)5/h10-11H,6-7H2,1-5H3
InChIKeyOQXWHZLVJXTBPG-UHFFFAOYSA-N
MW208.81 g/mol
LogP2.18
Rot. Bonds4

About N-[tert-butyl-chloro-(ethylamino)silyl]ethanamine

N-[tert-butyl-chloro-(ethylamino)silyl]ethanamine (PubChem CID 87334352) has the molecular formula C8H21ClN2Si and a molecular weight of 208.81 g/mol. Its IUPAC name is N-[tert-butyl-chloro-(ethylamino)silyl]ethanamine.

Molecular Properties

Compound NameN-[tert-butyl-chloro-(ethylamino)silyl]ethanamine
PubChem CID87334352
Molecular FormulaC8H21ClN2Si
Molecular Weight208.81 g/mol
Exact Mass208.12
IUPAC NameN-[tert-butyl-chloro-(ethylamino)silyl]ethanamine
SMILESCCN[Si](Cl)(NCC)C(C)(C)C
InChIInChI=1S/C8H21ClN2Si/c1-6-10-12(9,11-7-2)8(3,4)5/h10-11H,6-7H2,1-5H3
InChIKeyOQXWHZLVJXTBPG-UHFFFAOYSA-N
XLogP2.18
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.81
LogP ≤ 52.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'silicon_halogen', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-[tert-butyl-chloro-(ethylamino)silyl]ethanamine?
The IUPAC name of N-[tert-butyl-chloro-(ethylamino)silyl]ethanamine (CID 87334352) is N-[tert-butyl-chloro-(ethylamino)silyl]ethanamine.
What is the SMILES notation for N-[tert-butyl-chloro-(ethylamino)silyl]ethanamine?
The canonical SMILES for N-[tert-butyl-chloro-(ethylamino)silyl]ethanamine is CCN[Si](Cl)(NCC)C(C)(C)C.
What is the InChIKey of N-[tert-butyl-chloro-(ethylamino)silyl]ethanamine?
The InChIKey is OQXWHZLVJXTBPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H21ClN2Si/c1-6-10-12(9,11-7-2)8(3,4)5/h10-11H,6-7H2,1-5H3.
What are the key properties of N-[tert-butyl-chloro-(ethylamino)silyl]ethanamine?
N-[tert-butyl-chloro-(ethylamino)silyl]ethanamine has a molecular weight of 208.81 g/mol, XLogP of 2.18, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[tert-butyl-chloro-(ethylamino)silyl]ethanamine is sourced from PubChem (CID 87334352), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).