4-[4-(trifluoromethyl)phenyl]-6,7-dihydrothieno[3,2-c]pyridine

C14H10F3NS — CID 2739385

IUPAC4-[4-(trifluoromethyl)phenyl]-6,7-dihydrothieno[3,2-c]pyridine
SMILESFC(F)(F)c1ccc(C2=NCCc3sccc32)cc1
InChIInChI=1S/C14H10F3NS/c15-14(16,17)10-3-1-9(2-4-10)13-11-6-8-19-12(11)5-7-18-13/h1-4,6,8H,5,7H2
InChIKeyMPOSEWZEVGAKGR-UHFFFAOYSA-N
MW281.30 g/mol
LogP4.16
Rot. Bonds1

About 4-[4-(trifluoromethyl)phenyl]-6,7-dihydrothieno[3,2-c]pyridine

4-[4-(trifluoromethyl)phenyl]-6,7-dihydrothieno[3,2-c]pyridine (PubChem CID 2739385) has the molecular formula C14H10F3NS and a molecular weight of 281.30 g/mol. Its IUPAC name is 4-[4-(trifluoromethyl)phenyl]-6,7-dihydrothieno[3,2-c]pyridine.

Molecular Properties

Compound Name4-[4-(trifluoromethyl)phenyl]-6,7-dihydrothieno[3,2-c]pyridine
PubChem CID2739385
Molecular FormulaC14H10F3NS
Molecular Weight281.30 g/mol
Exact Mass281.05
IUPAC Name4-[4-(trifluoromethyl)phenyl]-6,7-dihydrothieno[3,2-c]pyridine
SMILESFC(F)(F)c1ccc(C2=NCCc3sccc32)cc1
InChIInChI=1S/C14H10F3NS/c15-14(16,17)10-3-1-9(2-4-10)13-11-6-8-19-12(11)5-7-18-13/h1-4,6,8H,5,7H2
InChIKeyMPOSEWZEVGAKGR-UHFFFAOYSA-N
XLogP4.16
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.30
LogP ≤ 54.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-[4-(trifluoromethyl)phenyl]-6,7-dihydrothieno[3,2-c]pyridine?
The IUPAC name of 4-[4-(trifluoromethyl)phenyl]-6,7-dihydrothieno[3,2-c]pyridine (CID 2739385) is 4-[4-(trifluoromethyl)phenyl]-6,7-dihydrothieno[3,2-c]pyridine.
What is the SMILES notation for 4-[4-(trifluoromethyl)phenyl]-6,7-dihydrothieno[3,2-c]pyridine?
The canonical SMILES for 4-[4-(trifluoromethyl)phenyl]-6,7-dihydrothieno[3,2-c]pyridine is FC(F)(F)c1ccc(C2=NCCc3sccc32)cc1.
What is the InChIKey of 4-[4-(trifluoromethyl)phenyl]-6,7-dihydrothieno[3,2-c]pyridine?
The InChIKey is MPOSEWZEVGAKGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10F3NS/c15-14(16,17)10-3-1-9(2-4-10)13-11-6-8-19-12(11)5-7-18-13/h1-4,6,8H,5,7H2.
What are the key properties of 4-[4-(trifluoromethyl)phenyl]-6,7-dihydrothieno[3,2-c]pyridine?
4-[4-(trifluoromethyl)phenyl]-6,7-dihydrothieno[3,2-c]pyridine has a molecular weight of 281.30 g/mol, XLogP of 4.16, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-(trifluoromethyl)phenyl]-6,7-dihydrothieno[3,2-c]pyridine is sourced from PubChem (CID 2739385), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).