3-bromo-2-(trifluoromethyl)pyridine;thiophene

C10H7BrF3NS — CID 155251528

IUPAC3-bromo-2-(trifluoromethyl)pyridine;thiophene
SMILESFC(F)(F)c1ncccc1Br.c1ccsc1
InChIInChI=1S/C6H3BrF3N.C4H4S/c7-4-2-1-3-11-5(4)6(8,9)10;1-2-4-5-3-1/h1-3H;1-4H
InChIKeyOCGJCCGUKRTFBW-UHFFFAOYSA-N
MW310.14 g/mol
LogP4.61
Rot. Bonds

About 3-bromo-2-(trifluoromethyl)pyridine;thiophene

3-bromo-2-(trifluoromethyl)pyridine;thiophene (PubChem CID 155251528) has the molecular formula C10H7BrF3NS and a molecular weight of 310.14 g/mol. Its IUPAC name is 3-bromo-2-(trifluoromethyl)pyridine;thiophene.

Molecular Properties

Compound Name3-bromo-2-(trifluoromethyl)pyridine;thiophene
PubChem CID155251528
Molecular FormulaC10H7BrF3NS
Molecular Weight310.14 g/mol
Exact Mass308.94
IUPAC Name3-bromo-2-(trifluoromethyl)pyridine;thiophene
SMILESFC(F)(F)c1ncccc1Br.c1ccsc1
InChIInChI=1S/C6H3BrF3N.C4H4S/c7-4-2-1-3-11-5(4)6(8,9)10;1-2-4-5-3-1/h1-3H;1-4H
InChIKeyOCGJCCGUKRTFBW-UHFFFAOYSA-N
XLogP4.61
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.14
LogP ≤ 54.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-bromo-2-(trifluoromethyl)pyridine;thiophene?
The IUPAC name of 3-bromo-2-(trifluoromethyl)pyridine;thiophene (CID 155251528) is 3-bromo-2-(trifluoromethyl)pyridine;thiophene.
What is the SMILES notation for 3-bromo-2-(trifluoromethyl)pyridine;thiophene?
The canonical SMILES for 3-bromo-2-(trifluoromethyl)pyridine;thiophene is FC(F)(F)c1ncccc1Br.c1ccsc1.
What is the InChIKey of 3-bromo-2-(trifluoromethyl)pyridine;thiophene?
The InChIKey is OCGJCCGUKRTFBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H3BrF3N.C4H4S/c7-4-2-1-3-11-5(4)6(8,9)10;1-2-4-5-3-1/h1-3H;1-4H.
What are the key properties of 3-bromo-2-(trifluoromethyl)pyridine;thiophene?
3-bromo-2-(trifluoromethyl)pyridine;thiophene has a molecular weight of 310.14 g/mol, XLogP of 4.61, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-bromo-2-(trifluoromethyl)pyridine;thiophene is sourced from PubChem (CID 155251528), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).