5-[(5-chlorothiophen-2-yl)methoxy]-2-fluoropyridine

C10H7ClFNOS — CID 115282938

IUPAC5-[(5-chlorothiophen-2-yl)methoxy]-2-fluoropyridine
SMILESFc1ccc(OCc2ccc(Cl)s2)cn1
InChIInChI=1S/C10H7ClFNOS/c11-9-3-2-8(15-9)6-14-7-1-4-10(12)13-5-7/h1-5H,6H2
InChIKeyKVLCNLAJIOAYHI-UHFFFAOYSA-N
MW243.69 g/mol
LogP3.51
Rot. Bonds3

About 5-[(5-chlorothiophen-2-yl)methoxy]-2-fluoropyridine

5-[(5-chlorothiophen-2-yl)methoxy]-2-fluoropyridine (PubChem CID 115282938) has the molecular formula C10H7ClFNOS and a molecular weight of 243.69 g/mol. Its IUPAC name is 5-[(5-chlorothiophen-2-yl)methoxy]-2-fluoropyridine.

Molecular Properties

Compound Name5-[(5-chlorothiophen-2-yl)methoxy]-2-fluoropyridine
PubChem CID115282938
Molecular FormulaC10H7ClFNOS
Molecular Weight243.69 g/mol
Exact Mass242.99
IUPAC Name5-[(5-chlorothiophen-2-yl)methoxy]-2-fluoropyridine
SMILESFc1ccc(OCc2ccc(Cl)s2)cn1
InChIInChI=1S/C10H7ClFNOS/c11-9-3-2-8(15-9)6-14-7-1-4-10(12)13-5-7/h1-5H,6H2
InChIKeyKVLCNLAJIOAYHI-UHFFFAOYSA-N
XLogP3.51
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.69
LogP ≤ 53.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 5-[(5-chlorothiophen-2-yl)methoxy]-2-fluoropyridine?
The IUPAC name of 5-[(5-chlorothiophen-2-yl)methoxy]-2-fluoropyridine (CID 115282938) is 5-[(5-chlorothiophen-2-yl)methoxy]-2-fluoropyridine.
What is the SMILES notation for 5-[(5-chlorothiophen-2-yl)methoxy]-2-fluoropyridine?
The canonical SMILES for 5-[(5-chlorothiophen-2-yl)methoxy]-2-fluoropyridine is Fc1ccc(OCc2ccc(Cl)s2)cn1.
What is the InChIKey of 5-[(5-chlorothiophen-2-yl)methoxy]-2-fluoropyridine?
The InChIKey is KVLCNLAJIOAYHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7ClFNOS/c11-9-3-2-8(15-9)6-14-7-1-4-10(12)13-5-7/h1-5H,6H2.
What are the key properties of 5-[(5-chlorothiophen-2-yl)methoxy]-2-fluoropyridine?
5-[(5-chlorothiophen-2-yl)methoxy]-2-fluoropyridine has a molecular weight of 243.69 g/mol, XLogP of 3.51, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(5-chlorothiophen-2-yl)methoxy]-2-fluoropyridine is sourced from PubChem (CID 115282938), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).