2-(2-fluorophenyl)-1-(3-methoxythiophen-2-yl)ethanamine

C13H14FNOS — CID 81121905

IUPAC2-(2-fluorophenyl)-1-(3-methoxythiophen-2-yl)ethanamine
SMILESCOc1ccsc1C(N)Cc1ccccc1F
InChIInChI=1S/C13H14FNOS/c1-16-12-6-7-17-13(12)11(15)8-9-4-2-3-5-10(9)14/h2-7,11H,8,15H2,1H3
InChIKeyVVRMQFNIAKGDQL-UHFFFAOYSA-N
MW251.33 g/mol
LogP3.14
Rot. Bonds4

About 2-(2-fluorophenyl)-1-(3-methoxythiophen-2-yl)ethanamine

2-(2-fluorophenyl)-1-(3-methoxythiophen-2-yl)ethanamine (PubChem CID 81121905) has the molecular formula C13H14FNOS and a molecular weight of 251.33 g/mol. Its IUPAC name is 2-(2-fluorophenyl)-1-(3-methoxythiophen-2-yl)ethanamine.

Molecular Properties

Compound Name2-(2-fluorophenyl)-1-(3-methoxythiophen-2-yl)ethanamine
PubChem CID81121905
Molecular FormulaC13H14FNOS
Molecular Weight251.33 g/mol
Exact Mass251.08
IUPAC Name2-(2-fluorophenyl)-1-(3-methoxythiophen-2-yl)ethanamine
SMILESCOc1ccsc1C(N)Cc1ccccc1F
InChIInChI=1S/C13H14FNOS/c1-16-12-6-7-17-13(12)11(15)8-9-4-2-3-5-10(9)14/h2-7,11H,8,15H2,1H3
InChIKeyVVRMQFNIAKGDQL-UHFFFAOYSA-N
XLogP3.14
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.33
LogP ≤ 53.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-chloro-5-fluorophenyl)-1-(3-methoxythiophen-2-yl)ethanamine
CID 102622497
N-[2-(2-fluorophenyl)-1-(3-methoxythiophen-2-yl)ethyl]propan-1-amine
CID 81121909
2-(2-chloro-4-fluorophenyl)-1-(3-methoxythiophen-2-yl)ethanamine
CID 115840443
1-(3-chlorothiophen-2-yl)-2-(2-methoxyphenyl)ethanamine
CID 80530112
2-(2-fluorophenyl)-1-(2-methylthiophen-3-yl)ethanamine
CID 102832102
2-(5-bromothiophen-2-yl)-1-(3-methoxythiophen-2-yl)ethanamine
CID 115840988
2-(2-fluorophenyl)-1-(4-methoxythiophen-2-yl)ethanamine
CID 81122039
4,4,4-trifluoro-1-(3-methoxythiophen-2-yl)butan-1-amine
CID 104992725
1-(2-fluorophenyl)-3-(2-methoxyphenyl)propan-2-ol
CID 61263658
1-(5-bromo-2-methoxy-4-methylphenyl)-2-(2-fluorophenyl)ethanamine
CID 65440683
[1-(3-methoxythiophen-2-yl)-2-(2-methylphenyl)ethyl]hydrazine
CID 105285283
2-(2-methylphenyl)-1-(3-methylthiophen-2-yl)ethanamine
CID 61078535

Frequently Asked Questions

What is the IUPAC name of 2-(2-fluorophenyl)-1-(3-methoxythiophen-2-yl)ethanamine?
The IUPAC name of 2-(2-fluorophenyl)-1-(3-methoxythiophen-2-yl)ethanamine (CID 81121905) is 2-(2-fluorophenyl)-1-(3-methoxythiophen-2-yl)ethanamine.
What is the SMILES notation for 2-(2-fluorophenyl)-1-(3-methoxythiophen-2-yl)ethanamine?
The canonical SMILES for 2-(2-fluorophenyl)-1-(3-methoxythiophen-2-yl)ethanamine is COc1ccsc1C(N)Cc1ccccc1F.
What is the InChIKey of 2-(2-fluorophenyl)-1-(3-methoxythiophen-2-yl)ethanamine?
The InChIKey is VVRMQFNIAKGDQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14FNOS/c1-16-12-6-7-17-13(12)11(15)8-9-4-2-3-5-10(9)14/h2-7,11H,8,15H2,1H3.
What are the key properties of 2-(2-fluorophenyl)-1-(3-methoxythiophen-2-yl)ethanamine?
2-(2-fluorophenyl)-1-(3-methoxythiophen-2-yl)ethanamine has a molecular weight of 251.33 g/mol, XLogP of 3.14, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluorophenyl)-1-(3-methoxythiophen-2-yl)ethanamine is sourced from PubChem (CID 81121905), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).