N-ethyl-2-(furan-2-yl)-1-[4-(trifluoromethoxy)phenyl]ethanamine

C15H16F3NO2 — CID 105029616

IUPACN-ethyl-2-(furan-2-yl)-1-[4-(trifluoromethoxy)phenyl]ethanamine
SMILESCCNC(Cc1ccco1)c1ccc(OC(F)(F)F)cc1
InChIInChI=1S/C15H16F3NO2/c1-2-19-14(10-13-4-3-9-20-13)11-5-7-12(8-6-11)21-15(16,17)18/h3-9,14,19H,2,10H2,1H3
InChIKeyAUZGXTZJTPKCPQ-UHFFFAOYSA-N
MW299.29 g/mol
LogP4.07
Rot. Bonds6

About N-ethyl-2-(furan-2-yl)-1-[4-(trifluoromethoxy)phenyl]ethanamine

N-ethyl-2-(furan-2-yl)-1-[4-(trifluoromethoxy)phenyl]ethanamine (PubChem CID 105029616) has the molecular formula C15H16F3NO2 and a molecular weight of 299.29 g/mol. Its IUPAC name is N-ethyl-2-(furan-2-yl)-1-[4-(trifluoromethoxy)phenyl]ethanamine.

Molecular Properties

Compound NameN-ethyl-2-(furan-2-yl)-1-[4-(trifluoromethoxy)phenyl]ethanamine
PubChem CID105029616
Molecular FormulaC15H16F3NO2
Molecular Weight299.29 g/mol
Exact Mass299.11
IUPAC NameN-ethyl-2-(furan-2-yl)-1-[4-(trifluoromethoxy)phenyl]ethanamine
SMILESCCNC(Cc1ccco1)c1ccc(OC(F)(F)F)cc1
InChIInChI=1S/C15H16F3NO2/c1-2-19-14(10-13-4-3-9-20-13)11-5-7-12(8-6-11)21-15(16,17)18/h3-9,14,19H,2,10H2,1H3
InChIKeyAUZGXTZJTPKCPQ-UHFFFAOYSA-N
XLogP4.07
TPSA34.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.29
LogP ≤ 54.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[4-(difluoromethoxy)phenyl]-N-ethyl-2-(furan-2-yl)ethanamine
CID 105029421
N-ethyl-1-[4-(trifluoromethoxy)phenyl]propan-1-amine
CID 114980102
N-ethyl-2-(furan-2-yl)-1-pyridin-4-ylethanamine
CID 83175492
N-[2-(furan-2-yl)-1-[4-(trifluoromethyl)phenyl]ethyl]propan-1-amine
CID 105029239
1-[3-(difluoromethoxy)phenyl]-N-ethyl-2-(furan-2-yl)ethanamine
CID 105029493
1-(3,4-dimethoxyphenyl)-N-ethyl-2-(furan-2-yl)ethanamine
CID 83175883
N-ethyl-3-(furan-2-yl)-1-(4-propan-2-yloxyphenyl)propan-1-amine
CID 105144630
N-ethyl-1-[4-(trifluoromethoxy)phenyl]but-3-en-1-amine
CID 115815205
N-ethyl-2-(furan-2-yl)-1-(4-methoxy-3-methylphenyl)ethanamine
CID 83183271
N-ethyl-1-(4-fluorophenyl)-3-(furan-2-yl)propan-1-amine
CID 105087868
N-ethyl-1-[4-(trifluoromethoxy)phenyl]ethanamine
CID 24697408
N-ethyl-4-methyl-1-[4-(trifluoromethoxy)phenyl]pent-4-en-1-amine
CID 105039774

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-(furan-2-yl)-1-[4-(trifluoromethoxy)phenyl]ethanamine?
The IUPAC name of N-ethyl-2-(furan-2-yl)-1-[4-(trifluoromethoxy)phenyl]ethanamine (CID 105029616) is N-ethyl-2-(furan-2-yl)-1-[4-(trifluoromethoxy)phenyl]ethanamine.
What is the SMILES notation for N-ethyl-2-(furan-2-yl)-1-[4-(trifluoromethoxy)phenyl]ethanamine?
The canonical SMILES for N-ethyl-2-(furan-2-yl)-1-[4-(trifluoromethoxy)phenyl]ethanamine is CCNC(Cc1ccco1)c1ccc(OC(F)(F)F)cc1.
What is the InChIKey of N-ethyl-2-(furan-2-yl)-1-[4-(trifluoromethoxy)phenyl]ethanamine?
The InChIKey is AUZGXTZJTPKCPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16F3NO2/c1-2-19-14(10-13-4-3-9-20-13)11-5-7-12(8-6-11)21-15(16,17)18/h3-9,14,19H,2,10H2,1H3.
What are the key properties of N-ethyl-2-(furan-2-yl)-1-[4-(trifluoromethoxy)phenyl]ethanamine?
N-ethyl-2-(furan-2-yl)-1-[4-(trifluoromethoxy)phenyl]ethanamine has a molecular weight of 299.29 g/mol, XLogP of 4.07, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-(furan-2-yl)-1-[4-(trifluoromethoxy)phenyl]ethanamine is sourced from PubChem (CID 105029616), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).