N-ethyl-2-(4-fluorophenyl)sulfanyl-1-(5-methylthiophen-2-yl)ethanamine

C15H18FNS2 — CID 66066896

IUPACN-ethyl-2-(4-fluorophenyl)sulfanyl-1-(5-methylthiophen-2-yl)ethanamine
SMILESCCNC(CSc1ccc(F)cc1)c1ccc(C)s1
InChIInChI=1S/C15H18FNS2/c1-3-17-14(15-9-4-11(2)19-15)10-18-13-7-5-12(16)6-8-13/h4-9,14,17H,3,10H2,1-2H3
InChIKeyAHOHYKBRMXNTDA-UHFFFAOYSA-N
MW295.45 g/mol
LogP4.64
Rot. Bonds6

About N-ethyl-2-(4-fluorophenyl)sulfanyl-1-(5-methylthiophen-2-yl)ethanamine

N-ethyl-2-(4-fluorophenyl)sulfanyl-1-(5-methylthiophen-2-yl)ethanamine (PubChem CID 66066896) has the molecular formula C15H18FNS2 and a molecular weight of 295.45 g/mol. Its IUPAC name is N-ethyl-2-(4-fluorophenyl)sulfanyl-1-(5-methylthiophen-2-yl)ethanamine.

Molecular Properties

Compound NameN-ethyl-2-(4-fluorophenyl)sulfanyl-1-(5-methylthiophen-2-yl)ethanamine
PubChem CID66066896
Molecular FormulaC15H18FNS2
Molecular Weight295.45 g/mol
Exact Mass295.09
IUPAC NameN-ethyl-2-(4-fluorophenyl)sulfanyl-1-(5-methylthiophen-2-yl)ethanamine
SMILESCCNC(CSc1ccc(F)cc1)c1ccc(C)s1
InChIInChI=1S/C15H18FNS2/c1-3-17-14(15-9-4-11(2)19-15)10-18-13-7-5-12(16)6-8-13/h4-9,14,17H,3,10H2,1-2H3
InChIKeyAHOHYKBRMXNTDA-UHFFFAOYSA-N
XLogP4.64
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.45
LogP ≤ 54.64
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
N-ethyl-2-(4-fluorophenyl)sulfanyl-1-(furan-3-yl)ethanamine
CID 66065314
N,3-diethyl-1-(5-methylthiophen-2-yl)pentan-1-amine
CID 105028432
1-(2,5-dichlorophenyl)-N-ethyl-2-(4-fluorophenyl)sulfanylethanamine
CID 66065312
1-(2-chloro-5-fluorophenyl)-N-ethyl-2-(4-methylphenyl)sulfanylethanamine
CID 105395115
2-(3-bromophenyl)sulfanyl-N-ethyl-1-(4-fluorophenyl)ethanamine
CID 66158848
N-ethyl-1-(5-methylthiophen-2-yl)ethanamine
CID 24705103
2-(3,4-dihydro-2H-chromen-4-yl)-N-ethyl-1-(5-methylthiophen-2-yl)ethanamine
CID 105034371
1-(5-bromothiophen-2-yl)-N-ethyl-3-(4-fluorophenyl)sulfanylpropan-2-amine
CID 66066895
N-ethyl-1-(4-fluorophenyl)-2-propylsulfanylethanamine
CID 65128632
N-ethyl-1-(4-fluoro-3-methylphenyl)-2-(4-methylphenyl)sulfanylethanamine
CID 66064232
N-ethyl-1-(4-fluorophenyl)sulfanylpent-4-yn-2-amine
CID 66073273

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-(4-fluorophenyl)sulfanyl-1-(5-methylthiophen-2-yl)ethanamine?
The IUPAC name of N-ethyl-2-(4-fluorophenyl)sulfanyl-1-(5-methylthiophen-2-yl)ethanamine (CID 66066896) is N-ethyl-2-(4-fluorophenyl)sulfanyl-1-(5-methylthiophen-2-yl)ethanamine.
What is the SMILES notation for N-ethyl-2-(4-fluorophenyl)sulfanyl-1-(5-methylthiophen-2-yl)ethanamine?
The canonical SMILES for N-ethyl-2-(4-fluorophenyl)sulfanyl-1-(5-methylthiophen-2-yl)ethanamine is CCNC(CSc1ccc(F)cc1)c1ccc(C)s1.
What is the InChIKey of N-ethyl-2-(4-fluorophenyl)sulfanyl-1-(5-methylthiophen-2-yl)ethanamine?
The InChIKey is AHOHYKBRMXNTDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18FNS2/c1-3-17-14(15-9-4-11(2)19-15)10-18-13-7-5-12(16)6-8-13/h4-9,14,17H,3,10H2,1-2H3.
What are the key properties of N-ethyl-2-(4-fluorophenyl)sulfanyl-1-(5-methylthiophen-2-yl)ethanamine?
N-ethyl-2-(4-fluorophenyl)sulfanyl-1-(5-methylthiophen-2-yl)ethanamine has a molecular weight of 295.45 g/mol, XLogP of 4.64, 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-(5-methylthiophen-2-yl)ethanamine is sourced from PubChem (CID 66066896), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).