N-(chloro-ethyl-propylsilyl)-N-ethylethanamine

C9H22ClNSi — CID 87334152

IUPACN-(chloro-ethyl-propylsilyl)-N-ethylethanamine
SMILESCCC[Si](Cl)(CC)N(CC)CC
InChIInChI=1S/C9H22ClNSi/c1-5-9-12(10,8-4)11(6-2)7-3/h5-9H2,1-4H3
InChIKeyCCEMYJUFPBMPSO-UHFFFAOYSA-N
MW207.82 g/mol
LogP3.44
Rot. Bonds6

About N-(chloro-ethyl-propylsilyl)-N-ethylethanamine

N-(chloro-ethyl-propylsilyl)-N-ethylethanamine (PubChem CID 87334152) has the molecular formula C9H22ClNSi and a molecular weight of 207.82 g/mol. Its IUPAC name is N-(chloro-ethyl-propylsilyl)-N-ethylethanamine.

Molecular Properties

Compound NameN-(chloro-ethyl-propylsilyl)-N-ethylethanamine
PubChem CID87334152
Molecular FormulaC9H22ClNSi
Molecular Weight207.82 g/mol
Exact Mass207.12
IUPAC NameN-(chloro-ethyl-propylsilyl)-N-ethylethanamine
SMILESCCC[Si](Cl)(CC)N(CC)CC
InChIInChI=1S/C9H22ClNSi/c1-5-9-12(10,8-4)11(6-2)7-3/h5-9H2,1-4H3
InChIKeyCCEMYJUFPBMPSO-UHFFFAOYSA-N
XLogP3.44
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.82
LogP ≤ 53.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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-ethyl-propylsilyl)-N-ethylethanamine?
The IUPAC name of N-(chloro-ethyl-propylsilyl)-N-ethylethanamine (CID 87334152) is N-(chloro-ethyl-propylsilyl)-N-ethylethanamine.
What is the SMILES notation for N-(chloro-ethyl-propylsilyl)-N-ethylethanamine?
The canonical SMILES for N-(chloro-ethyl-propylsilyl)-N-ethylethanamine is CCC[Si](Cl)(CC)N(CC)CC.
What is the InChIKey of N-(chloro-ethyl-propylsilyl)-N-ethylethanamine?
The InChIKey is CCEMYJUFPBMPSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H22ClNSi/c1-5-9-12(10,8-4)11(6-2)7-3/h5-9H2,1-4H3.
What are the key properties of N-(chloro-ethyl-propylsilyl)-N-ethylethanamine?
N-(chloro-ethyl-propylsilyl)-N-ethylethanamine has a molecular weight of 207.82 g/mol, XLogP of 3.44, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(chloro-ethyl-propylsilyl)-N-ethylethanamine is sourced from PubChem (CID 87334152), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).