N-ethyl-1-(4-fluorophenyl)-2-(furan-3-yl)ethanamine

C14H16FNO — CID 83174702

IUPACN-ethyl-1-(4-fluorophenyl)-2-(furan-3-yl)ethanamine
SMILESCCNC(Cc1ccoc1)c1ccc(F)cc1
InChIInChI=1S/C14H16FNO/c1-2-16-14(9-11-7-8-17-10-11)12-3-5-13(15)6-4-12/h3-8,10,14,16H,2,9H2,1H3
InChIKeyYOFYKJWOTAGCJN-UHFFFAOYSA-N
MW233.29 g/mol
LogP3.31
Rot. Bonds5

About N-ethyl-1-(4-fluorophenyl)-2-(furan-3-yl)ethanamine

N-ethyl-1-(4-fluorophenyl)-2-(furan-3-yl)ethanamine (PubChem CID 83174702) has the molecular formula C14H16FNO and a molecular weight of 233.29 g/mol. Its IUPAC name is N-ethyl-1-(4-fluorophenyl)-2-(furan-3-yl)ethanamine.

Molecular Properties

Compound NameN-ethyl-1-(4-fluorophenyl)-2-(furan-3-yl)ethanamine
PubChem CID83174702
Molecular FormulaC14H16FNO
Molecular Weight233.29 g/mol
Exact Mass233.12
IUPAC NameN-ethyl-1-(4-fluorophenyl)-2-(furan-3-yl)ethanamine
SMILESCCNC(Cc1ccoc1)c1ccc(F)cc1
InChIInChI=1S/C14H16FNO/c1-2-16-14(9-11-7-8-17-10-11)12-3-5-13(15)6-4-12/h3-8,10,14,16H,2,9H2,1H3
InChIKeyYOFYKJWOTAGCJN-UHFFFAOYSA-N
XLogP3.31
TPSA25.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.29
LogP ≤ 53.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(4-fluorophenyl)-2-(furan-3-yl)-N-methylethanamine
CID 83176188
1-(4-tert-butylphenyl)-N-ethyl-2-(furan-3-yl)ethanamine
CID 105030207
N-ethyl-1-(3-fluoro-5-methylphenyl)-2-(furan-3-yl)ethanamine
CID 83182969
N-ethyl-1-(4-fluoro-3-methylphenyl)-2-(furan-3-yl)ethanamine
CID 83174718
1-(2,6-difluorophenyl)-N-ethyl-2-(furan-3-yl)ethanamine
CID 83182160
N-ethyl-1-[5-fluoro-2-(trifluoromethyl)phenyl]-2-(furan-3-yl)ethanamine
CID 83178416
N-ethyl-1-(2-fluorophenyl)-2-(furan-3-yl)ethanamine
CID 83175625
1-(2,3-difluorophenyl)-N-ethyl-2-(furan-3-yl)ethanamine
CID 105029849
1-(5-bromo-3-pyridinyl)-N-ethyl-2-(furan-3-yl)ethanamine
CID 83183662
N-ethyl-1-(2-fluoro-4-methylphenyl)-2-(furan-3-yl)ethanamine
CID 105030020
N-ethyl-2-(furan-3-yl)-1-(5-methylfuran-2-yl)ethanamine
CID 105029983
1-(3-ethoxyphenyl)-N-ethyl-2-(furan-3-yl)ethanamine
CID 83175084

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-(4-fluorophenyl)-2-(furan-3-yl)ethanamine?
The IUPAC name of N-ethyl-1-(4-fluorophenyl)-2-(furan-3-yl)ethanamine (CID 83174702) is N-ethyl-1-(4-fluorophenyl)-2-(furan-3-yl)ethanamine.
What is the SMILES notation for N-ethyl-1-(4-fluorophenyl)-2-(furan-3-yl)ethanamine?
The canonical SMILES for N-ethyl-1-(4-fluorophenyl)-2-(furan-3-yl)ethanamine is CCNC(Cc1ccoc1)c1ccc(F)cc1.
What is the InChIKey of N-ethyl-1-(4-fluorophenyl)-2-(furan-3-yl)ethanamine?
The InChIKey is YOFYKJWOTAGCJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16FNO/c1-2-16-14(9-11-7-8-17-10-11)12-3-5-13(15)6-4-12/h3-8,10,14,16H,2,9H2,1H3.
What are the key properties of N-ethyl-1-(4-fluorophenyl)-2-(furan-3-yl)ethanamine?
N-ethyl-1-(4-fluorophenyl)-2-(furan-3-yl)ethanamine has a molecular weight of 233.29 g/mol, XLogP of 3.31, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-(4-fluorophenyl)-2-(furan-3-yl)ethanamine is sourced from PubChem (CID 83174702), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).