N-ethyl-1-(4-thiophen-2-ylsulfanylphenyl)ethanamine

C14H17NS2 — CID 43286479

IUPACN-ethyl-1-(4-thiophen-2-ylsulfanylphenyl)ethanamine
SMILESCCNC(C)c1ccc(Sc2cccs2)cc1
InChIInChI=1S/C14H17NS2/c1-3-15-11(2)12-6-8-13(9-7-12)17-14-5-4-10-16-14/h4-11,15H,3H2,1-2H3
InChIKeyHJHXOKSPXXWTAE-UHFFFAOYSA-N
MW263.43 g/mol
LogP4.57
Rot. Bonds5

About N-ethyl-1-(4-thiophen-2-ylsulfanylphenyl)ethanamine

N-ethyl-1-(4-thiophen-2-ylsulfanylphenyl)ethanamine (PubChem CID 43286479) has the molecular formula C14H17NS2 and a molecular weight of 263.43 g/mol. Its IUPAC name is N-ethyl-1-(4-thiophen-2-ylsulfanylphenyl)ethanamine.

Molecular Properties

Compound NameN-ethyl-1-(4-thiophen-2-ylsulfanylphenyl)ethanamine
PubChem CID43286479
Molecular FormulaC14H17NS2
Molecular Weight263.43 g/mol
Exact Mass263.08
IUPAC NameN-ethyl-1-(4-thiophen-2-ylsulfanylphenyl)ethanamine
SMILESCCNC(C)c1ccc(Sc2cccs2)cc1
InChIInChI=1S/C14H17NS2/c1-3-15-11(2)12-6-8-13(9-7-12)17-14-5-4-10-16-14/h4-11,15H,3H2,1-2H3
InChIKeyHJHXOKSPXXWTAE-UHFFFAOYSA-N
XLogP4.57
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.43
LogP ≤ 54.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-(4-thiophen-2-ylsulfanylphenyl)ethyl]propan-1-amine
CID 43286478
(1S)-1-(4-thiophen-2-ylsulfanylphenyl)ethanamine
CID 28602971
2-(4-propylphenyl)sulfanylthiophene
CID 67533746
1-[4-(4,6-dimethylpyrimidin-2-yl)sulfanylphenyl]-N-ethylethanamine
CID 62304633
1-[4-[(4,5-dimethyl-1,2,4-triazol-3-yl)sulfanyl]phenyl]-N-ethylethanamine
CID 63533066
4-[1-(ethylamino)ethyl]-N-propan-2-yl-N-(thiophen-2-ylmethyl)aniline
CID 61451157
N-[4-[1-(ethylamino)ethyl]phenyl]thiophene-2-sulfonamide
CID 43508090
N-(thiophen-2-ylsulfanylmethyl)propan-2-amine
CID 117032909
N-ethyl-1-[4-(1,3-thiazol-5-ylmethylsulfanyl)phenyl]ethanamine
CID 112644501
N-ethyl-1-[4-(4-methylpyrimidin-2-yl)sulfanylphenyl]ethanamine
CID 62268390
N-ethyl-1-(4-phenoxyphenyl)ethanamine
CID 43285534
N-ethyl-1-(4-fluorophenyl)ethanamine
CID 21251078

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-(4-thiophen-2-ylsulfanylphenyl)ethanamine?
The IUPAC name of N-ethyl-1-(4-thiophen-2-ylsulfanylphenyl)ethanamine (CID 43286479) is N-ethyl-1-(4-thiophen-2-ylsulfanylphenyl)ethanamine.
What is the SMILES notation for N-ethyl-1-(4-thiophen-2-ylsulfanylphenyl)ethanamine?
The canonical SMILES for N-ethyl-1-(4-thiophen-2-ylsulfanylphenyl)ethanamine is CCNC(C)c1ccc(Sc2cccs2)cc1.
What is the InChIKey of N-ethyl-1-(4-thiophen-2-ylsulfanylphenyl)ethanamine?
The InChIKey is HJHXOKSPXXWTAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17NS2/c1-3-15-11(2)12-6-8-13(9-7-12)17-14-5-4-10-16-14/h4-11,15H,3H2,1-2H3.
What are the key properties of N-ethyl-1-(4-thiophen-2-ylsulfanylphenyl)ethanamine?
N-ethyl-1-(4-thiophen-2-ylsulfanylphenyl)ethanamine has a molecular weight of 263.43 g/mol, XLogP of 4.57, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-(4-thiophen-2-ylsulfanylphenyl)ethanamine is sourced from PubChem (CID 43286479), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).