N-[chloro-(diethylamino)-methylsilyl]-N-ethylethanamine

C9H23ClN2Si — CID 11009572

IUPACN-[chloro-(diethylamino)-methylsilyl]-N-ethylethanamine
SMILESCCN(CC)[Si](C)(Cl)N(CC)CC
InChIInChI=1S/C9H23ClN2Si/c1-6-11(7-2)13(5,10)12(8-3)9-4/h6-9H2,1-5H3
InChIKeyAMADUIXVEMFCQX-UHFFFAOYSA-N
MW222.84 g/mol
LogP2.48
Rot. Bonds6

About N-[chloro-(diethylamino)-methylsilyl]-N-ethylethanamine

N-[chloro-(diethylamino)-methylsilyl]-N-ethylethanamine (PubChem CID 11009572) has the molecular formula C9H23ClN2Si and a molecular weight of 222.84 g/mol. Its IUPAC name is N-[chloro-(diethylamino)-methylsilyl]-N-ethylethanamine.

Molecular Properties

Compound NameN-[chloro-(diethylamino)-methylsilyl]-N-ethylethanamine
PubChem CID11009572
Molecular FormulaC9H23ClN2Si
Molecular Weight222.84 g/mol
Exact Mass222.13
IUPAC NameN-[chloro-(diethylamino)-methylsilyl]-N-ethylethanamine
SMILESCCN(CC)[Si](C)(Cl)N(CC)CC
InChIInChI=1S/C9H23ClN2Si/c1-6-11(7-2)13(5,10)12(8-3)9-4/h6-9H2,1-5H3
InChIKeyAMADUIXVEMFCQX-UHFFFAOYSA-N
XLogP2.48
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.84
LogP ≤ 52.48
H-Bond Donors ≤ 50
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-[chloro-(diethylamino)-methylsilyl]-N-ethylethanamine?
The IUPAC name of N-[chloro-(diethylamino)-methylsilyl]-N-ethylethanamine (CID 11009572) is N-[chloro-(diethylamino)-methylsilyl]-N-ethylethanamine.
What is the SMILES notation for N-[chloro-(diethylamino)-methylsilyl]-N-ethylethanamine?
The canonical SMILES for N-[chloro-(diethylamino)-methylsilyl]-N-ethylethanamine is CCN(CC)[Si](C)(Cl)N(CC)CC.
What is the InChIKey of N-[chloro-(diethylamino)-methylsilyl]-N-ethylethanamine?
The InChIKey is AMADUIXVEMFCQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H23ClN2Si/c1-6-11(7-2)13(5,10)12(8-3)9-4/h6-9H2,1-5H3.
What are the key properties of N-[chloro-(diethylamino)-methylsilyl]-N-ethylethanamine?
N-[chloro-(diethylamino)-methylsilyl]-N-ethylethanamine has a molecular weight of 222.84 g/mol, XLogP of 2.48, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[chloro-(diethylamino)-methylsilyl]-N-ethylethanamine is sourced from PubChem (CID 11009572), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).