3-[2-aminoethyl(trifluoromethyl)silyl]propan-1-amine

C6H15F3N2Si — CID 160886976

IUPAC3-[2-aminoethyl(trifluoromethyl)silyl]propan-1-amine
SMILESNCCC[SiH](CCN)C(F)(F)F
InChIInChI=1S/C6H15F3N2Si/c7-6(8,9)12(5-3-11)4-1-2-10/h12H,1-5,10-11H2
InChIKeySNTOAOWSPCLOTC-UHFFFAOYSA-N
MW200.28 g/mol
LogP0.62
Rot. Bonds5

About 3-[2-aminoethyl(trifluoromethyl)silyl]propan-1-amine

3-[2-aminoethyl(trifluoromethyl)silyl]propan-1-amine (PubChem CID 160886976) has the molecular formula C6H15F3N2Si and a molecular weight of 200.28 g/mol. Its IUPAC name is 3-[2-aminoethyl(trifluoromethyl)silyl]propan-1-amine.

Molecular Properties

Compound Name3-[2-aminoethyl(trifluoromethyl)silyl]propan-1-amine
PubChem CID160886976
Molecular FormulaC6H15F3N2Si
Molecular Weight200.28 g/mol
Exact Mass200.10
IUPAC Name3-[2-aminoethyl(trifluoromethyl)silyl]propan-1-amine
SMILESNCCC[SiH](CCN)C(F)(F)F
InChIInChI=1S/C6H15F3N2Si/c7-6(8,9)12(5-3-11)4-1-2-10/h12H,1-5,10-11H2
InChIKeySNTOAOWSPCLOTC-UHFFFAOYSA-N
XLogP0.62
TPSA52.04 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.28
LogP ≤ 50.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

5,5,5-trichloropentan-1-amine
CID 23423634
3,3,3-tri(18F)fluoropropan-1-amine
CID 10154023
10,10,10-trifluorodecan-1-amine
CID 151642080
3-aminopropan-1-ol;2,2,2-trifluoroacetic acid
CID 87715709
3-dichlorosilylpropan-1-amine
CID 154152160
3-fluoropropan-1-amine
CID 10019
4-[2,3-difluoro-5-(2-fluoropropan-2-yl)phenyl]butan-1-amine
CID 117365180
4,4,5,5-tetrafluoropentan-1-amine
CID 130986187
CID 21315680
CID 21315680
icosane-1,20-diamine;nonadecane-1,19-diamine
CID 155315822
20,21,21,21-tetrafluoro-20-(trifluoromethyl)henicosan-1-amine
CID 155015019
3-(trifluoromethylsulfanyl)propan-1-amine chloride
CID 75530535

Frequently Asked Questions

What is the IUPAC name of 3-[2-aminoethyl(trifluoromethyl)silyl]propan-1-amine?
The IUPAC name of 3-[2-aminoethyl(trifluoromethyl)silyl]propan-1-amine (CID 160886976) is 3-[2-aminoethyl(trifluoromethyl)silyl]propan-1-amine.
What is the SMILES notation for 3-[2-aminoethyl(trifluoromethyl)silyl]propan-1-amine?
The canonical SMILES for 3-[2-aminoethyl(trifluoromethyl)silyl]propan-1-amine is NCCC[SiH](CCN)C(F)(F)F.
What is the InChIKey of 3-[2-aminoethyl(trifluoromethyl)silyl]propan-1-amine?
The InChIKey is SNTOAOWSPCLOTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H15F3N2Si/c7-6(8,9)12(5-3-11)4-1-2-10/h12H,1-5,10-11H2.
What are the key properties of 3-[2-aminoethyl(trifluoromethyl)silyl]propan-1-amine?
3-[2-aminoethyl(trifluoromethyl)silyl]propan-1-amine has a molecular weight of 200.28 g/mol, XLogP of 0.62, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-aminoethyl(trifluoromethyl)silyl]propan-1-amine is sourced from PubChem (CID 160886976), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).