N,N-diethyl-1-trichlorosilylpropan-1-amine

C7H16Cl3NSi — CID 174844337

IUPACN,N-diethyl-1-trichlorosilylpropan-1-amine
SMILESCCC(N(CC)CC)[Si](Cl)(Cl)Cl
InChIInChI=1S/C7H16Cl3NSi/c1-4-7(12(8,9)10)11(5-2)6-3/h7H,4-6H2,1-3H3
InChIKeyNSEJMLDPPOEHSO-UHFFFAOYSA-N
MW248.66 g/mol
LogP3.30
Rot. Bonds5

About N,N-diethyl-1-trichlorosilylpropan-1-amine

N,N-diethyl-1-trichlorosilylpropan-1-amine (PubChem CID 174844337) has the molecular formula C7H16Cl3NSi and a molecular weight of 248.66 g/mol. Its IUPAC name is N,N-diethyl-1-trichlorosilylpropan-1-amine.

Molecular Properties

Compound NameN,N-diethyl-1-trichlorosilylpropan-1-amine
PubChem CID174844337
Molecular FormulaC7H16Cl3NSi
Molecular Weight248.66 g/mol
Exact Mass247.01
IUPAC NameN,N-diethyl-1-trichlorosilylpropan-1-amine
SMILESCCC(N(CC)CC)[Si](Cl)(Cl)Cl
InChIInChI=1S/C7H16Cl3NSi/c1-4-7(12(8,9)10)11(5-2)6-3/h7H,4-6H2,1-3H3
InChIKeyNSEJMLDPPOEHSO-UHFFFAOYSA-N
XLogP3.30
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.66
LogP ≤ 53.30
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,N-diethyl-1-trichlorosilylpropan-1-amine?
The IUPAC name of N,N-diethyl-1-trichlorosilylpropan-1-amine (CID 174844337) is N,N-diethyl-1-trichlorosilylpropan-1-amine.
What is the SMILES notation for N,N-diethyl-1-trichlorosilylpropan-1-amine?
The canonical SMILES for N,N-diethyl-1-trichlorosilylpropan-1-amine is CCC(N(CC)CC)[Si](Cl)(Cl)Cl.
What is the InChIKey of N,N-diethyl-1-trichlorosilylpropan-1-amine?
The InChIKey is NSEJMLDPPOEHSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16Cl3NSi/c1-4-7(12(8,9)10)11(5-2)6-3/h7H,4-6H2,1-3H3.
What are the key properties of N,N-diethyl-1-trichlorosilylpropan-1-amine?
N,N-diethyl-1-trichlorosilylpropan-1-amine has a molecular weight of 248.66 g/mol, XLogP of 3.30, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-1-trichlorosilylpropan-1-amine is sourced from PubChem (CID 174844337), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).