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

C14H16FNOS — CID 66065314

IUPACN-ethyl-2-(4-fluorophenyl)sulfanyl-1-(furan-3-yl)ethanamine
SMILESCCNC(CSc1ccc(F)cc1)c1ccoc1
InChIInChI=1S/C14H16FNOS/c1-2-16-14(11-7-8-17-9-11)10-18-13-5-3-12(15)4-6-13/h3-9,14,16H,2,10H2,1H3
InChIKeyRSIRRYPGNSCKJG-UHFFFAOYSA-N
MW265.35 g/mol
LogP3.86
Rot. Bonds6

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

N-ethyl-2-(4-fluorophenyl)sulfanyl-1-(furan-3-yl)ethanamine (PubChem CID 66065314) has the molecular formula C14H16FNOS and a molecular weight of 265.35 g/mol. Its IUPAC name is N-ethyl-2-(4-fluorophenyl)sulfanyl-1-(furan-3-yl)ethanamine.

Molecular Properties

Compound NameN-ethyl-2-(4-fluorophenyl)sulfanyl-1-(furan-3-yl)ethanamine
PubChem CID66065314
Molecular FormulaC14H16FNOS
Molecular Weight265.35 g/mol
Exact Mass265.09
IUPAC NameN-ethyl-2-(4-fluorophenyl)sulfanyl-1-(furan-3-yl)ethanamine
SMILESCCNC(CSc1ccc(F)cc1)c1ccoc1
InChIInChI=1S/C14H16FNOS/c1-2-16-14(11-7-8-17-9-11)10-18-13-5-3-12(15)4-6-13/h3-9,14,16H,2,10H2,1H3
InChIKeyRSIRRYPGNSCKJG-UHFFFAOYSA-N
XLogP3.86
TPSA25.17 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.35
LogP ≤ 53.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-2-(4-fluorophenyl)sulfanyl-1-thiophen-3-ylethanamine
CID 66073061
2-butan-2-ylsulfanyl-N-ethyl-1-(furan-3-yl)ethanamine
CID 65136268
1-(4-fluorophenyl)sulfanyl-3-(furan-3-yl)-N-propylpropan-2-amine
CID 83176061
N-ethyl-1-(4-fluorophenyl)-2-(furan-3-yl)ethanamine
CID 83174702
N-ethyl-2-(4-fluorophenyl)sulfanyl-1-(5-methylthiophen-2-yl)ethanamine
CID 66066896
2-(2-chloro-4-fluorophenyl)-N-ethyl-1-(furan-3-yl)ethanamine
CID 63949608
N-ethyl-1-(furan-3-yl)-3-methylsulfanylpropan-1-amine
CID 105146707
N-[furan-3-yl-(4-methylsulfanylphenyl)methyl]ethanamine
CID 115855604
1-(2,5-dichlorophenyl)-N-ethyl-2-(4-fluorophenyl)sulfanylethanamine
CID 66065312
N-ethyl-1-(furan-3-yl)-3-methoxypropan-1-amine
CID 63948181
N-[1-(1-ethylpyrazol-4-yl)-2-(4-fluorophenyl)sulfanylethyl]propan-1-amine
CID 66065121
2-(3-bromophenyl)sulfanyl-N-ethyl-1-(4-fluorophenyl)ethanamine
CID 66158848

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-(4-fluorophenyl)sulfanyl-1-(furan-3-yl)ethanamine?
The IUPAC name of N-ethyl-2-(4-fluorophenyl)sulfanyl-1-(furan-3-yl)ethanamine (CID 66065314) is N-ethyl-2-(4-fluorophenyl)sulfanyl-1-(furan-3-yl)ethanamine.
What is the SMILES notation for N-ethyl-2-(4-fluorophenyl)sulfanyl-1-(furan-3-yl)ethanamine?
The canonical SMILES for N-ethyl-2-(4-fluorophenyl)sulfanyl-1-(furan-3-yl)ethanamine is CCNC(CSc1ccc(F)cc1)c1ccoc1.
What is the InChIKey of N-ethyl-2-(4-fluorophenyl)sulfanyl-1-(furan-3-yl)ethanamine?
The InChIKey is RSIRRYPGNSCKJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16FNOS/c1-2-16-14(11-7-8-17-9-11)10-18-13-5-3-12(15)4-6-13/h3-9,14,16H,2,10H2,1H3.
What are the key properties of N-ethyl-2-(4-fluorophenyl)sulfanyl-1-(furan-3-yl)ethanamine?
N-ethyl-2-(4-fluorophenyl)sulfanyl-1-(furan-3-yl)ethanamine has a molecular weight of 265.35 g/mol, XLogP of 3.86, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-(4-fluorophenyl)sulfanyl-1-(furan-3-yl)ethanamine is sourced from PubChem (CID 66065314), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).