(1R)-1-(4-fluorophenyl)-N-[1-(2,4,6-trimethylphenyl)ethyl]ethanamine

C19H24FN — CID 81351118

IUPAC(1R)-1-(4-fluorophenyl)-N-[1-(2,4,6-trimethylphenyl)ethyl]ethanamine
SMILESCc1cc(C)c(C(C)N[C@H](C)c2ccc(F)cc2)c(C)c1
InChIInChI=1S/C19H24FN/c1-12-10-13(2)19(14(3)11-12)16(5)21-15(4)17-6-8-18(20)9-7-17/h6-11,15-16,21H,1-5H3/t15-,16?/m1/s1
InChIKeyAFLGUBXDFHYRAJ-AAFJCEBUSA-N
MW285.41 g/mol
LogP5.16
Rot. Bonds4

About (1R)-1-(4-fluorophenyl)-N-[1-(2,4,6-trimethylphenyl)ethyl]ethanamine

(1R)-1-(4-fluorophenyl)-N-[1-(2,4,6-trimethylphenyl)ethyl]ethanamine (PubChem CID 81351118) has the molecular formula C19H24FN and a molecular weight of 285.41 g/mol. Its IUPAC name is (1R)-1-(4-fluorophenyl)-N-[1-(2,4,6-trimethylphenyl)ethyl]ethanamine.

Molecular Properties

Compound Name(1R)-1-(4-fluorophenyl)-N-[1-(2,4,6-trimethylphenyl)ethyl]ethanamine
PubChem CID81351118
Molecular FormulaC19H24FN
Molecular Weight285.41 g/mol
Exact Mass285.19
IUPAC Name(1R)-1-(4-fluorophenyl)-N-[1-(2,4,6-trimethylphenyl)ethyl]ethanamine
SMILESCc1cc(C)c(C(C)N[C@H](C)c2ccc(F)cc2)c(C)c1
InChIInChI=1S/C19H24FN/c1-12-10-13(2)19(14(3)11-12)16(5)21-15(4)17-6-8-18(20)9-7-17/h6-11,15-16,21H,1-5H3/t15-,16?/m1/s1
InChIKeyAFLGUBXDFHYRAJ-AAFJCEBUSA-N
XLogP5.16
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500285.41
LogP ≤ 55.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(1S)-1-(4-bromophenyl)-N-[1-(2,4,6-trimethylphenyl)ethyl]ethanamine
CID 81356704
N-[1-(4-fluorophenyl)ethyl]-2,4,6-trimethylaniline
CID 63448200
(1R)-1-(4-fluorophenyl)-N-[1-(3-methylphenyl)ethyl]ethanamine
CID 81350639
1-(4-fluorophenyl)-N-[(1S)-1-(3-methylphenyl)ethyl]ethanamine
CID 81363847
(1S)-1-(3-methylphenyl)-N-[1-(2,4,6-trimethylphenyl)ethyl]ethanamine
CID 81367068
(1S)-1-(4-fluorophenyl)-N-[1-(3-methylphenyl)ethyl]ethanamine
CID 81347759
2-[bis(4-fluorophenyl)methyl]-1,3,5-trimethylbenzene
CID 102424992
N-[1-(2,6-difluorophenyl)ethyl]-1-(4-fluorophenyl)ethanamine
CID 43201964
(1R)-N-[1-(4-fluorophenyl)ethyl]-1-phenylethanamine
CID 78956090
N-[1-(2,4,6-trimethylphenyl)ethyl]propan-2-amine
CID 43190075
3-[1-[1-(2,4,6-trimethylphenyl)ethylamino]ethyl]phenol
CID 43748567
N-[(1R)-1-(4-bromophenyl)ethyl]-1-(4-fluorophenyl)ethanamine
CID 81354443

Frequently Asked Questions

What is the IUPAC name of (1R)-1-(4-fluorophenyl)-N-[1-(2,4,6-trimethylphenyl)ethyl]ethanamine?
The IUPAC name of (1R)-1-(4-fluorophenyl)-N-[1-(2,4,6-trimethylphenyl)ethyl]ethanamine (CID 81351118) is (1R)-1-(4-fluorophenyl)-N-[1-(2,4,6-trimethylphenyl)ethyl]ethanamine.
What is the SMILES notation for (1R)-1-(4-fluorophenyl)-N-[1-(2,4,6-trimethylphenyl)ethyl]ethanamine?
The canonical SMILES for (1R)-1-(4-fluorophenyl)-N-[1-(2,4,6-trimethylphenyl)ethyl]ethanamine is Cc1cc(C)c(C(C)N[C@H](C)c2ccc(F)cc2)c(C)c1.
What is the InChIKey of (1R)-1-(4-fluorophenyl)-N-[1-(2,4,6-trimethylphenyl)ethyl]ethanamine?
The InChIKey is AFLGUBXDFHYRAJ-AAFJCEBUSA-N. The full InChI is InChI=1S/C19H24FN/c1-12-10-13(2)19(14(3)11-12)16(5)21-15(4)17-6-8-18(20)9-7-17/h6-11,15-16,21H,1-5H3/t15-,16?/m1/s1.
What are the key properties of (1R)-1-(4-fluorophenyl)-N-[1-(2,4,6-trimethylphenyl)ethyl]ethanamine?
(1R)-1-(4-fluorophenyl)-N-[1-(2,4,6-trimethylphenyl)ethyl]ethanamine has a molecular weight of 285.41 g/mol, XLogP of 5.16, 4 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-[1-(2,4,6-trimethylphenyl)ethyl]ethanamine is sourced from PubChem (CID 81351118), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).