7-[2-[4-(4-fluorophenoxy)piperidin-1-yl]ethyl]-6,7-dihydro-5H-cyclopenta[c]pyridine

C21H25FN2O — CID 134242981

IUPAC7-[2-[4-(4-fluorophenoxy)piperidin-1-yl]ethyl]-6,7-dihydro-5H-cyclopenta[c]pyridine
SMILESFc1ccc(OC2CCN(CCC3CCc4ccncc43)CC2)cc1
InChIInChI=1S/C21H25FN2O/c22-18-3-5-19(6-4-18)25-20-9-13-24(14-10-20)12-8-17-2-1-16-7-11-23-15-21(16)17/h3-7,11,15,17,20H,1-2,8-10,12-14H2
InChIKeyUHGXFKKRRYCFOX-UHFFFAOYSA-N
MW340.44 g/mol
LogP4.18
Rot. Bonds5

About 7-[2-[4-(4-fluorophenoxy)piperidin-1-yl]ethyl]-6,7-dihydro-5H-cyclopenta[c]pyridine

7-[2-[4-(4-fluorophenoxy)piperidin-1-yl]ethyl]-6,7-dihydro-5H-cyclopenta[c]pyridine (PubChem CID 134242981) has the molecular formula C21H25FN2O and a molecular weight of 340.44 g/mol. Its IUPAC name is 7-[2-[4-(4-fluorophenoxy)piperidin-1-yl]ethyl]-6,7-dihydro-5H-cyclopenta[c]pyridine.

Molecular Properties

Compound Name7-[2-[4-(4-fluorophenoxy)piperidin-1-yl]ethyl]-6,7-dihydro-5H-cyclopenta[c]pyridine
PubChem CID134242981
Molecular FormulaC21H25FN2O
Molecular Weight340.44 g/mol
Exact Mass340.20
IUPAC Name7-[2-[4-(4-fluorophenoxy)piperidin-1-yl]ethyl]-6,7-dihydro-5H-cyclopenta[c]pyridine
SMILESFc1ccc(OC2CCN(CCC3CCc4ccncc43)CC2)cc1
InChIInChI=1S/C21H25FN2O/c22-18-3-5-19(6-4-18)25-20-9-13-24(14-10-20)12-8-17-2-1-16-7-11-23-15-21(16)17/h3-7,11,15,17,20H,1-2,8-10,12-14H2
InChIKeyUHGXFKKRRYCFOX-UHFFFAOYSA-N
XLogP4.18
TPSA25.36 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.44
LogP ≤ 54.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 7-[2-[4-(4-fluorophenoxy)piperidin-1-yl]ethyl]-6,7-dihydro-5H-cyclopenta[c]pyridine?
The IUPAC name of 7-[2-[4-(4-fluorophenoxy)piperidin-1-yl]ethyl]-6,7-dihydro-5H-cyclopenta[c]pyridine (CID 134242981) is 7-[2-[4-(4-fluorophenoxy)piperidin-1-yl]ethyl]-6,7-dihydro-5H-cyclopenta[c]pyridine.
What is the SMILES notation for 7-[2-[4-(4-fluorophenoxy)piperidin-1-yl]ethyl]-6,7-dihydro-5H-cyclopenta[c]pyridine?
The canonical SMILES for 7-[2-[4-(4-fluorophenoxy)piperidin-1-yl]ethyl]-6,7-dihydro-5H-cyclopenta[c]pyridine is Fc1ccc(OC2CCN(CCC3CCc4ccncc43)CC2)cc1.
What is the InChIKey of 7-[2-[4-(4-fluorophenoxy)piperidin-1-yl]ethyl]-6,7-dihydro-5H-cyclopenta[c]pyridine?
The InChIKey is UHGXFKKRRYCFOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H25FN2O/c22-18-3-5-19(6-4-18)25-20-9-13-24(14-10-20)12-8-17-2-1-16-7-11-23-15-21(16)17/h3-7,11,15,17,20H,1-2,8-10,12-14H2.
What are the key properties of 7-[2-[4-(4-fluorophenoxy)piperidin-1-yl]ethyl]-6,7-dihydro-5H-cyclopenta[c]pyridine?
7-[2-[4-(4-fluorophenoxy)piperidin-1-yl]ethyl]-6,7-dihydro-5H-cyclopenta[c]pyridine has a molecular weight of 340.44 g/mol, XLogP of 4.18, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[2-[4-(4-fluorophenoxy)piperidin-1-yl]ethyl]-6,7-dihydro-5H-cyclopenta[c]pyridine is sourced from PubChem (CID 134242981), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).