N-[2-(trifluoromethyl)phenyl]thiophen-2-amine

C11H8F3NS — CID 70144074

IUPACN-[2-(trifluoromethyl)phenyl]thiophen-2-amine
SMILESFC(F)(F)c1ccccc1Nc1cccs1
InChIInChI=1S/C11H8F3NS/c12-11(13,14)8-4-1-2-5-9(8)15-10-6-3-7-16-10/h1-7,15H
InChIKeyOBOXKKFBHCUUMA-UHFFFAOYSA-N
MW243.25 g/mol
LogP4.51
Rot. Bonds2

About N-[2-(trifluoromethyl)phenyl]thiophen-2-amine

N-[2-(trifluoromethyl)phenyl]thiophen-2-amine (PubChem CID 70144074) has the molecular formula C11H8F3NS and a molecular weight of 243.25 g/mol. Its IUPAC name is N-[2-(trifluoromethyl)phenyl]thiophen-2-amine.

Molecular Properties

Compound NameN-[2-(trifluoromethyl)phenyl]thiophen-2-amine
PubChem CID70144074
Molecular FormulaC11H8F3NS
Molecular Weight243.25 g/mol
Exact Mass243.03
IUPAC NameN-[2-(trifluoromethyl)phenyl]thiophen-2-amine
SMILESFC(F)(F)c1ccccc1Nc1cccs1
InChIInChI=1S/C11H8F3NS/c12-11(13,14)8-4-1-2-5-9(8)15-10-6-3-7-16-10/h1-7,15H
InChIKeyOBOXKKFBHCUUMA-UHFFFAOYSA-N
XLogP4.51
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.25
LogP ≤ 54.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[2-(trifluoromethyl)phenyl]thiophen-2-amine?
The IUPAC name of N-[2-(trifluoromethyl)phenyl]thiophen-2-amine (CID 70144074) is N-[2-(trifluoromethyl)phenyl]thiophen-2-amine.
What is the SMILES notation for N-[2-(trifluoromethyl)phenyl]thiophen-2-amine?
The canonical SMILES for N-[2-(trifluoromethyl)phenyl]thiophen-2-amine is FC(F)(F)c1ccccc1Nc1cccs1.
What is the InChIKey of N-[2-(trifluoromethyl)phenyl]thiophen-2-amine?
The InChIKey is OBOXKKFBHCUUMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8F3NS/c12-11(13,14)8-4-1-2-5-9(8)15-10-6-3-7-16-10/h1-7,15H.
What are the key properties of N-[2-(trifluoromethyl)phenyl]thiophen-2-amine?
N-[2-(trifluoromethyl)phenyl]thiophen-2-amine has a molecular weight of 243.25 g/mol, XLogP of 4.51, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(trifluoromethyl)phenyl]thiophen-2-amine is sourced from PubChem (CID 70144074), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).