(1R)-1-(4-fluorophenyl)-N-[(4-trimethylsilylphenyl)methyl]ethanamine

C18H24FNSi — CID 103437945

IUPAC(1R)-1-(4-fluorophenyl)-N-[(4-trimethylsilylphenyl)methyl]ethanamine
SMILESC[C@@H](NCc1ccc([Si](C)(C)C)cc1)c1ccc(F)cc1
InChIInChI=1S/C18H24FNSi/c1-14(16-7-9-17(19)10-8-16)20-13-15-5-11-18(12-6-15)21(2,3)4/h5-12,14,20H,13H2,1-4H3/t14-/m1/s1
InChIKeyMHRNBUMMWZXBGI-CQSZACIVSA-N
MW301.48 g/mol
LogP4.22
Rot. Bonds5

About (1R)-1-(4-fluorophenyl)-N-[(4-trimethylsilylphenyl)methyl]ethanamine

(1R)-1-(4-fluorophenyl)-N-[(4-trimethylsilylphenyl)methyl]ethanamine (PubChem CID 103437945) has the molecular formula C18H24FNSi and a molecular weight of 301.48 g/mol. Its IUPAC name is (1R)-1-(4-fluorophenyl)-N-[(4-trimethylsilylphenyl)methyl]ethanamine.

Molecular Properties

Compound Name(1R)-1-(4-fluorophenyl)-N-[(4-trimethylsilylphenyl)methyl]ethanamine
PubChem CID103437945
Molecular FormulaC18H24FNSi
Molecular Weight301.48 g/mol
Exact Mass301.17
IUPAC Name(1R)-1-(4-fluorophenyl)-N-[(4-trimethylsilylphenyl)methyl]ethanamine
SMILESC[C@@H](NCc1ccc([Si](C)(C)C)cc1)c1ccc(F)cc1
InChIInChI=1S/C18H24FNSi/c1-14(16-7-9-17(19)10-8-16)20-13-15-5-11-18(12-6-15)21(2,3)4/h5-12,14,20H,13H2,1-4H3/t14-/m1/s1
InChIKeyMHRNBUMMWZXBGI-CQSZACIVSA-N
XLogP4.22
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.48
LogP ≤ 54.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

(1R)-1-(4-methylphenyl)-N-[(4-trimethylsilylphenyl)methyl]ethanamine
CID 103437947
N-[(4-ethylphenyl)methyl]-1-(4-fluorophenyl)ethanamine
CID 43078764
(1R)-N-[(4-bromophenyl)methyl]-1-(4-fluorophenyl)ethanamine
CID 28622733
(1S)-1-(4-fluorophenyl)-N-(pyridin-4-ylmethyl)ethanamine
CID 28669780
4-[1-[(4-fluorophenyl)methylamino]ethyl]phenol
CID 43194830
N-[(4-fluorophenyl)methyl]-1-phenylethanamine
CID 2758971
(1S)-1-(4-fluorophenyl)-N-[(4-methylsulfanylphenyl)methyl]ethanamine
CID 28623639
(1R)-N-[(3,5-difluorophenyl)methyl]-1-(4-fluorophenyl)ethanamine
CID 96938323
2-[4-[[[(1S)-1-(4-fluorophenyl)ethyl]amino]methyl]phenyl]acetic acid
CID 103257154
(1R)-N-[(3,4-dimethylphenyl)methyl]-1-(4-fluorophenyl)ethanamine
CID 81347067
(1R)-1-(3-chlorophenyl)-N-[(4-trimethylsilylphenyl)methyl]ethanamine
CID 103437957
(1R)-N-[(3-chloro-4-fluorophenyl)methyl]-1-(4-fluorophenyl)ethanamine
CID 81350945

Frequently Asked Questions

What is the IUPAC name of (1R)-1-(4-fluorophenyl)-N-[(4-trimethylsilylphenyl)methyl]ethanamine?
The IUPAC name of (1R)-1-(4-fluorophenyl)-N-[(4-trimethylsilylphenyl)methyl]ethanamine (CID 103437945) is (1R)-1-(4-fluorophenyl)-N-[(4-trimethylsilylphenyl)methyl]ethanamine.
What is the SMILES notation for (1R)-1-(4-fluorophenyl)-N-[(4-trimethylsilylphenyl)methyl]ethanamine?
The canonical SMILES for (1R)-1-(4-fluorophenyl)-N-[(4-trimethylsilylphenyl)methyl]ethanamine is C[C@@H](NCc1ccc([Si](C)(C)C)cc1)c1ccc(F)cc1.
What is the InChIKey of (1R)-1-(4-fluorophenyl)-N-[(4-trimethylsilylphenyl)methyl]ethanamine?
The InChIKey is MHRNBUMMWZXBGI-CQSZACIVSA-N. The full InChI is InChI=1S/C18H24FNSi/c1-14(16-7-9-17(19)10-8-16)20-13-15-5-11-18(12-6-15)21(2,3)4/h5-12,14,20H,13H2,1-4H3/t14-/m1/s1.
What are the key properties of (1R)-1-(4-fluorophenyl)-N-[(4-trimethylsilylphenyl)methyl]ethanamine?
(1R)-1-(4-fluorophenyl)-N-[(4-trimethylsilylphenyl)methyl]ethanamine has a molecular weight of 301.48 g/mol, XLogP of 4.22, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-(4-fluorophenyl)-N-[(4-trimethylsilylphenyl)methyl]ethanamine is sourced from PubChem (CID 103437945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).