2-chloro-3-fluoro-5-methylthieno[3,2-b]pyridine

C8H5ClFNS — CID 19002854

IUPAC2-chloro-3-fluoro-5-methylthieno[3,2-b]pyridine
SMILESCc1ccc2sc(Cl)c(F)c2n1
InChIInChI=1S/C8H5ClFNS/c1-4-2-3-5-7(11-4)6(10)8(9)12-5/h2-3H,1H3
InChIKeyTXOMVJYQDGMBCH-UHFFFAOYSA-N
MW201.65 g/mol
LogP3.40
Rot. Bonds

About 2-chloro-3-fluoro-5-methylthieno[3,2-b]pyridine

2-chloro-3-fluoro-5-methylthieno[3,2-b]pyridine (PubChem CID 19002854) has the molecular formula C8H5ClFNS and a molecular weight of 201.65 g/mol. Its IUPAC name is 2-chloro-3-fluoro-5-methylthieno[3,2-b]pyridine.

Molecular Properties

Compound Name2-chloro-3-fluoro-5-methylthieno[3,2-b]pyridine
PubChem CID19002854
Molecular FormulaC8H5ClFNS
Molecular Weight201.65 g/mol
Exact Mass200.98
IUPAC Name2-chloro-3-fluoro-5-methylthieno[3,2-b]pyridine
SMILESCc1ccc2sc(Cl)c(F)c2n1
InChIInChI=1S/C8H5ClFNS/c1-4-2-3-5-7(11-4)6(10)8(9)12-5/h2-3H,1H3
InChIKeyTXOMVJYQDGMBCH-UHFFFAOYSA-N
XLogP3.40
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.65
LogP ≤ 53.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-chloro-3-fluoro-5-methylthieno[3,2-b]pyridine?
The IUPAC name of 2-chloro-3-fluoro-5-methylthieno[3,2-b]pyridine (CID 19002854) is 2-chloro-3-fluoro-5-methylthieno[3,2-b]pyridine.
What is the SMILES notation for 2-chloro-3-fluoro-5-methylthieno[3,2-b]pyridine?
The canonical SMILES for 2-chloro-3-fluoro-5-methylthieno[3,2-b]pyridine is Cc1ccc2sc(Cl)c(F)c2n1.
What is the InChIKey of 2-chloro-3-fluoro-5-methylthieno[3,2-b]pyridine?
The InChIKey is TXOMVJYQDGMBCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H5ClFNS/c1-4-2-3-5-7(11-4)6(10)8(9)12-5/h2-3H,1H3.
What are the key properties of 2-chloro-3-fluoro-5-methylthieno[3,2-b]pyridine?
2-chloro-3-fluoro-5-methylthieno[3,2-b]pyridine has a molecular weight of 201.65 g/mol, XLogP of 3.40, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-3-fluoro-5-methylthieno[3,2-b]pyridine is sourced from PubChem (CID 19002854), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).