5-[(2-fluorophenyl)methyl]-6-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridine

C15H16FNS — CID 15887853

IUPAC5-[(2-fluorophenyl)methyl]-6-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridine
SMILESCC1Cc2sccc2CN1Cc1ccccc1F
InChIInChI=1S/C15H16FNS/c1-11-8-15-13(6-7-18-15)10-17(11)9-12-4-2-3-5-14(12)16/h2-7,11H,8-10H2,1H3
InChIKeyAXXUHAJAGAYAKO-UHFFFAOYSA-N
MW261.37 g/mol
LogP3.83
Rot. Bonds2

About 5-[(2-fluorophenyl)methyl]-6-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridine

5-[(2-fluorophenyl)methyl]-6-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridine (PubChem CID 15887853) has the molecular formula C15H16FNS and a molecular weight of 261.37 g/mol. Its IUPAC name is 5-[(2-fluorophenyl)methyl]-6-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridine.

Molecular Properties

Compound Name5-[(2-fluorophenyl)methyl]-6-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridine
PubChem CID15887853
Molecular FormulaC15H16FNS
Molecular Weight261.37 g/mol
Exact Mass261.10
IUPAC Name5-[(2-fluorophenyl)methyl]-6-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridine
SMILESCC1Cc2sccc2CN1Cc1ccccc1F
InChIInChI=1S/C15H16FNS/c1-11-8-15-13(6-7-18-15)10-17(11)9-12-4-2-3-5-14(12)16/h2-7,11H,8-10H2,1H3
InChIKeyAXXUHAJAGAYAKO-UHFFFAOYSA-N
XLogP3.83
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 53.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-[(2-fluorophenyl)methyl]-6-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridine?
The IUPAC name of 5-[(2-fluorophenyl)methyl]-6-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridine (CID 15887853) is 5-[(2-fluorophenyl)methyl]-6-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridine.
What is the SMILES notation for 5-[(2-fluorophenyl)methyl]-6-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridine?
The canonical SMILES for 5-[(2-fluorophenyl)methyl]-6-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridine is CC1Cc2sccc2CN1Cc1ccccc1F.
What is the InChIKey of 5-[(2-fluorophenyl)methyl]-6-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridine?
The InChIKey is AXXUHAJAGAYAKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16FNS/c1-11-8-15-13(6-7-18-15)10-17(11)9-12-4-2-3-5-14(12)16/h2-7,11H,8-10H2,1H3.
What are the key properties of 5-[(2-fluorophenyl)methyl]-6-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridine?
5-[(2-fluorophenyl)methyl]-6-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridine has a molecular weight of 261.37 g/mol, XLogP of 3.83, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(2-fluorophenyl)methyl]-6-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridine is sourced from PubChem (CID 15887853), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).