(1R)-1-[5-fluoro-2-(2-thiophen-2-ylethoxy)phenyl]ethanamine

C14H16FNOS — CID 63370121

IUPAC(1R)-1-[5-fluoro-2-(2-thiophen-2-ylethoxy)phenyl]ethanamine
SMILESC[C@@H](N)c1cc(F)ccc1OCCc1cccs1
InChIInChI=1S/C14H16FNOS/c1-10(16)13-9-11(15)4-5-14(13)17-7-6-12-3-2-8-18-12/h2-5,8-10H,6-7,16H2,1H3/t10-/m1/s1
InChIKeyIBBFIHWPRYBKLO-SNVBAGLBSA-N
MW265.35 g/mol
LogP3.53
Rot. Bonds5

About (1R)-1-[5-fluoro-2-(2-thiophen-2-ylethoxy)phenyl]ethanamine

(1R)-1-[5-fluoro-2-(2-thiophen-2-ylethoxy)phenyl]ethanamine (PubChem CID 63370121) has the molecular formula C14H16FNOS and a molecular weight of 265.35 g/mol. Its IUPAC name is (1R)-1-[5-fluoro-2-(2-thiophen-2-ylethoxy)phenyl]ethanamine.

Molecular Properties

Compound Name(1R)-1-[5-fluoro-2-(2-thiophen-2-ylethoxy)phenyl]ethanamine
PubChem CID63370121
Molecular FormulaC14H16FNOS
Molecular Weight265.35 g/mol
Exact Mass265.09
IUPAC Name(1R)-1-[5-fluoro-2-(2-thiophen-2-ylethoxy)phenyl]ethanamine
SMILESC[C@@H](N)c1cc(F)ccc1OCCc1cccs1
InChIInChI=1S/C14H16FNOS/c1-10(16)13-9-11(15)4-5-14(13)17-7-6-12-3-2-8-18-12/h2-5,8-10H,6-7,16H2,1H3/t10-/m1/s1
InChIKeyIBBFIHWPRYBKLO-SNVBAGLBSA-N
XLogP3.53
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.35
LogP ≤ 53.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[2-(2-thiophen-2-ylethoxy)phenyl]ethanamine
CID 54966969
1-[5-chloro-2-(2-thiophen-2-ylethoxy)phenyl]ethanamine
CID 63775282
1-[5-fluoro-2-(2-thiophen-2-ylethoxy)phenyl]propan-2-amine
CID 107700843
1-[5-fluoro-2-(2-phenylethoxy)phenyl]ethanamine
CID 43128588
(1S)-1-[4-bromo-2-(2-thiophen-2-ylethoxy)phenyl]ethanamine
CID 102947209
(1R)-1-(5-fluoro-2-pentoxyphenyl)ethanamine
CID 63370186
(1R)-1-[5-fluoro-2-(3-pyridin-4-ylpropoxy)phenyl]ethanamine
CID 29006434
(1S)-1-[2-(2-thiophen-2-ylethoxy)phenyl]ethanol
CID 78951125
5-fluoro-2-(2-thiophen-2-ylethoxy)benzonitrile
CID 55232319
2-[2-(4-bromo-2-propan-2-ylphenoxy)ethyl]thiophene
CID 113302910
1-(5-fluoro-2-methoxyphenyl)-2-thiophen-2-ylethanamine
CID 82769620
N-[[5-fluoro-2-(2-thiophen-2-ylethoxy)phenyl]methyl]-2-methylpropan-2-amine
CID 107696673

Frequently Asked Questions

What is the IUPAC name of (1R)-1-[5-fluoro-2-(2-thiophen-2-ylethoxy)phenyl]ethanamine?
The IUPAC name of (1R)-1-[5-fluoro-2-(2-thiophen-2-ylethoxy)phenyl]ethanamine (CID 63370121) is (1R)-1-[5-fluoro-2-(2-thiophen-2-ylethoxy)phenyl]ethanamine.
What is the SMILES notation for (1R)-1-[5-fluoro-2-(2-thiophen-2-ylethoxy)phenyl]ethanamine?
The canonical SMILES for (1R)-1-[5-fluoro-2-(2-thiophen-2-ylethoxy)phenyl]ethanamine is C[C@@H](N)c1cc(F)ccc1OCCc1cccs1.
What is the InChIKey of (1R)-1-[5-fluoro-2-(2-thiophen-2-ylethoxy)phenyl]ethanamine?
The InChIKey is IBBFIHWPRYBKLO-SNVBAGLBSA-N. The full InChI is InChI=1S/C14H16FNOS/c1-10(16)13-9-11(15)4-5-14(13)17-7-6-12-3-2-8-18-12/h2-5,8-10H,6-7,16H2,1H3/t10-/m1/s1.
What are the key properties of (1R)-1-[5-fluoro-2-(2-thiophen-2-ylethoxy)phenyl]ethanamine?
(1R)-1-[5-fluoro-2-(2-thiophen-2-ylethoxy)phenyl]ethanamine has a molecular weight of 265.35 g/mol, XLogP of 3.53, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-[5-fluoro-2-(2-thiophen-2-ylethoxy)phenyl]ethanamine is sourced from PubChem (CID 63370121), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).