5-[4-(trifluoromethoxy)phenyl]thiophen-2-amine

C11H8F3NOS — CID 19014313

IUPAC5-[4-(trifluoromethoxy)phenyl]thiophen-2-amine
SMILESNc1ccc(-c2ccc(OC(F)(F)F)cc2)s1
InChIInChI=1S/C11H8F3NOS/c12-11(13,14)16-8-3-1-7(2-4-8)9-5-6-10(15)17-9/h1-6H,15H2
InChIKeyDVYIDUDMLINMKF-UHFFFAOYSA-N
MW259.25 g/mol
LogP3.90
Rot. Bonds2

About 5-[4-(trifluoromethoxy)phenyl]thiophen-2-amine

5-[4-(trifluoromethoxy)phenyl]thiophen-2-amine (PubChem CID 19014313) has the molecular formula C11H8F3NOS and a molecular weight of 259.25 g/mol. Its IUPAC name is 5-[4-(trifluoromethoxy)phenyl]thiophen-2-amine.

Molecular Properties

Compound Name5-[4-(trifluoromethoxy)phenyl]thiophen-2-amine
PubChem CID19014313
Molecular FormulaC11H8F3NOS
Molecular Weight259.25 g/mol
Exact Mass259.03
IUPAC Name5-[4-(trifluoromethoxy)phenyl]thiophen-2-amine
SMILESNc1ccc(-c2ccc(OC(F)(F)F)cc2)s1
InChIInChI=1S/C11H8F3NOS/c12-11(13,14)16-8-3-1-7(2-4-8)9-5-6-10(15)17-9/h1-6H,15H2
InChIKeyDVYIDUDMLINMKF-UHFFFAOYSA-N
XLogP3.90
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.25
LogP ≤ 53.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(5-(4-Methoxyphenyl)thiophen-2-yl)benzenamine
CID 44408839
5-Methoxybenzo[b]thiophen-2-amine
CID 67305134
4-[4-(4-Methylphenoxy)phenyl]thiophen-2-amine;hydroiodide
CID 171356315
Thiophene, 2-(4-methoxyphenyl)-5-nitro-
CID 10998963
5-(4-Methoxyphenyl)thiophen-3-amine
CID 101521625
5-[4-(Difluoromethoxy)phenyl]thiophen-2-amine
CID 19014321
4-Methyl-5-[4-(trifluoromethoxy)phenyl]thiophen-2-amine
CID 20026745
3-Methoxy-4-[5-(trifluoromethyl)thiophen-2-yl]aniline
CID 20231434
4-[[4-(Trifluoromethoxy)phenyl]methylsulfanyl]aniline
CID 43299438
1-[5-[4-(Trifluoromethoxy)phenyl]thiophen-2-yl]pyrrolidine
CID 57202363
2-Isocyano-5-[3-(trifluoromethyl)phenoxy]thiophene
CID 58104551
[5-[4-(Trifluoromethoxy)phenyl]thiophen-2-yl]methanamine
CID 64312224

Frequently Asked Questions

What is the IUPAC name of 5-[4-(trifluoromethoxy)phenyl]thiophen-2-amine?
The IUPAC name of 5-[4-(trifluoromethoxy)phenyl]thiophen-2-amine (CID 19014313) is 5-[4-(trifluoromethoxy)phenyl]thiophen-2-amine.
What is the SMILES notation for 5-[4-(trifluoromethoxy)phenyl]thiophen-2-amine?
The canonical SMILES for 5-[4-(trifluoromethoxy)phenyl]thiophen-2-amine is Nc1ccc(-c2ccc(OC(F)(F)F)cc2)s1.
What is the InChIKey of 5-[4-(trifluoromethoxy)phenyl]thiophen-2-amine?
The InChIKey is DVYIDUDMLINMKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8F3NOS/c12-11(13,14)16-8-3-1-7(2-4-8)9-5-6-10(15)17-9/h1-6H,15H2.
What are the key properties of 5-[4-(trifluoromethoxy)phenyl]thiophen-2-amine?
5-[4-(trifluoromethoxy)phenyl]thiophen-2-amine has a molecular weight of 259.25 g/mol, XLogP of 3.90, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[4-(trifluoromethoxy)phenyl]thiophen-2-amine is sourced from PubChem (CID 19014313), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).