N-ethyl-1-[5-(5-fluoro-2-methylphenyl)thiophen-2-yl]ethanamine

C15H18FNS — CID 43287860

IUPACN-ethyl-1-[5-(5-fluoro-2-methylphenyl)thiophen-2-yl]ethanamine
SMILESCCNC(C)c1ccc(-c2cc(F)ccc2C)s1
InChIInChI=1S/C15H18FNS/c1-4-17-11(3)14-7-8-15(18-14)13-9-12(16)6-5-10(13)2/h5-9,11,17H,4H2,1-3H3
InChIKeyQXZGOUZENQKQFH-UHFFFAOYSA-N
MW263.38 g/mol
LogP4.53
Rot. Bonds4

About N-ethyl-1-[5-(5-fluoro-2-methylphenyl)thiophen-2-yl]ethanamine

N-ethyl-1-[5-(5-fluoro-2-methylphenyl)thiophen-2-yl]ethanamine (PubChem CID 43287860) has the molecular formula C15H18FNS and a molecular weight of 263.38 g/mol. Its IUPAC name is N-ethyl-1-[5-(5-fluoro-2-methylphenyl)thiophen-2-yl]ethanamine.

Molecular Properties

Compound NameN-ethyl-1-[5-(5-fluoro-2-methylphenyl)thiophen-2-yl]ethanamine
PubChem CID43287860
Molecular FormulaC15H18FNS
Molecular Weight263.38 g/mol
Exact Mass263.11
IUPAC NameN-ethyl-1-[5-(5-fluoro-2-methylphenyl)thiophen-2-yl]ethanamine
SMILESCCNC(C)c1ccc(-c2cc(F)ccc2C)s1
InChIInChI=1S/C15H18FNS/c1-4-17-11(3)14-7-8-15(18-14)13-9-12(16)6-5-10(13)2/h5-9,11,17H,4H2,1-3H3
InChIKeyQXZGOUZENQKQFH-UHFFFAOYSA-N
XLogP4.53
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 54.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[5-(2,5-dimethylphenyl)thiophen-2-yl]-N-ethylethanamine
CID 43287935
N-ethyl-1-[5-(3-fluoro-5-methylphenyl)thiophen-2-yl]ethanamine
CID 79049374
N-[1-[5-(2-bromo-4-fluorophenyl)thiophen-2-yl]ethyl]propan-1-amine
CID 43288225
1-[5-(2-chloro-5-fluorophenyl)thiophen-2-yl]-N-ethyl-2-methylpropan-1-amine
CID 107530684
N-ethyl-1-[2-(5-fluoro-2-methylphenyl)phenyl]ethanamine
CID 54911658
1-[5-(2-chloro-5-fluorophenyl)thiophen-2-yl]-N-methylethanamine
CID 107530688
N-ethyl-1-[5-[2-(trifluoromethyl)phenyl]thiophen-2-yl]ethanamine
CID 43287447
1-[5-(4-bromo-2-chlorophenyl)thiophen-2-yl]-N-ethylethanamine
CID 43288278
N-[1-[5-(3-fluoro-5-methylphenyl)thiophen-2-yl]ethyl]propan-1-amine
CID 79049605
N-ethyl-1-(5-methylthiophen-2-yl)ethanamine
CID 24705103
N-ethyl-1-[5-(2,4,6-trichlorophenyl)thiophen-2-yl]ethanamine
CID 43288121
1-[5-(2,5-difluoro-4-methylphenyl)thiophen-2-yl]-N-ethylpropan-1-amine
CID 103586914

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-[5-(5-fluoro-2-methylphenyl)thiophen-2-yl]ethanamine?
The IUPAC name of N-ethyl-1-[5-(5-fluoro-2-methylphenyl)thiophen-2-yl]ethanamine (CID 43287860) is N-ethyl-1-[5-(5-fluoro-2-methylphenyl)thiophen-2-yl]ethanamine.
What is the SMILES notation for N-ethyl-1-[5-(5-fluoro-2-methylphenyl)thiophen-2-yl]ethanamine?
The canonical SMILES for N-ethyl-1-[5-(5-fluoro-2-methylphenyl)thiophen-2-yl]ethanamine is CCNC(C)c1ccc(-c2cc(F)ccc2C)s1.
What is the InChIKey of N-ethyl-1-[5-(5-fluoro-2-methylphenyl)thiophen-2-yl]ethanamine?
The InChIKey is QXZGOUZENQKQFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18FNS/c1-4-17-11(3)14-7-8-15(18-14)13-9-12(16)6-5-10(13)2/h5-9,11,17H,4H2,1-3H3.
What are the key properties of N-ethyl-1-[5-(5-fluoro-2-methylphenyl)thiophen-2-yl]ethanamine?
N-ethyl-1-[5-(5-fluoro-2-methylphenyl)thiophen-2-yl]ethanamine has a molecular weight of 263.38 g/mol, XLogP of 4.53, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-[5-(5-fluoro-2-methylphenyl)thiophen-2-yl]ethanamine is sourced from PubChem (CID 43287860), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).