4-(4-fluorophenyl)-1-[(3-methoxyphenyl)methyl]-3,6-dihydro-2H-pyridine

C19H20FNO — CID 756476

IUPAC4-(4-fluorophenyl)-1-[(3-methoxyphenyl)methyl]-3,6-dihydro-2H-pyridine
SMILESCOc1cccc(CN2CC=C(c3ccc(F)cc3)CC2)c1
InChIInChI=1S/C19H20FNO/c1-22-19-4-2-3-15(13-19)14-21-11-9-17(10-12-21)16-5-7-18(20)8-6-16/h2-9,13H,10-12,14H2,1H3
InChIKeyKWOMMDJELOYSFL-UHFFFAOYSA-N
MW297.37 g/mol
LogP4.12
Rot. Bonds4

About 4-(4-fluorophenyl)-1-[(3-methoxyphenyl)methyl]-3,6-dihydro-2H-pyridine

4-(4-fluorophenyl)-1-[(3-methoxyphenyl)methyl]-3,6-dihydro-2H-pyridine (PubChem CID 756476) has the molecular formula C19H20FNO and a molecular weight of 297.37 g/mol. Its IUPAC name is 4-(4-fluorophenyl)-1-[(3-methoxyphenyl)methyl]-3,6-dihydro-2H-pyridine.

Molecular Properties

Compound Name4-(4-fluorophenyl)-1-[(3-methoxyphenyl)methyl]-3,6-dihydro-2H-pyridine
PubChem CID756476
Molecular FormulaC19H20FNO
Molecular Weight297.37 g/mol
Exact Mass297.15
IUPAC Name4-(4-fluorophenyl)-1-[(3-methoxyphenyl)methyl]-3,6-dihydro-2H-pyridine
SMILESCOc1cccc(CN2CC=C(c3ccc(F)cc3)CC2)c1
InChIInChI=1S/C19H20FNO/c1-22-19-4-2-3-15(13-19)14-21-11-9-17(10-12-21)16-5-7-18(20)8-6-16/h2-9,13H,10-12,14H2,1H3
InChIKeyKWOMMDJELOYSFL-UHFFFAOYSA-N
XLogP4.12
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.37
LogP ≤ 54.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-(4-fluorophenyl)-1-[(3-methoxyphenyl)methyl]-3,6-dihydro-2H-pyridine?
The IUPAC name of 4-(4-fluorophenyl)-1-[(3-methoxyphenyl)methyl]-3,6-dihydro-2H-pyridine (CID 756476) is 4-(4-fluorophenyl)-1-[(3-methoxyphenyl)methyl]-3,6-dihydro-2H-pyridine.
What is the SMILES notation for 4-(4-fluorophenyl)-1-[(3-methoxyphenyl)methyl]-3,6-dihydro-2H-pyridine?
The canonical SMILES for 4-(4-fluorophenyl)-1-[(3-methoxyphenyl)methyl]-3,6-dihydro-2H-pyridine is COc1cccc(CN2CC=C(c3ccc(F)cc3)CC2)c1.
What is the InChIKey of 4-(4-fluorophenyl)-1-[(3-methoxyphenyl)methyl]-3,6-dihydro-2H-pyridine?
The InChIKey is KWOMMDJELOYSFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20FNO/c1-22-19-4-2-3-15(13-19)14-21-11-9-17(10-12-21)16-5-7-18(20)8-6-16/h2-9,13H,10-12,14H2,1H3.
What are the key properties of 4-(4-fluorophenyl)-1-[(3-methoxyphenyl)methyl]-3,6-dihydro-2H-pyridine?
4-(4-fluorophenyl)-1-[(3-methoxyphenyl)methyl]-3,6-dihydro-2H-pyridine has a molecular weight of 297.37 g/mol, XLogP of 4.12, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-fluorophenyl)-1-[(3-methoxyphenyl)methyl]-3,6-dihydro-2H-pyridine is sourced from PubChem (CID 756476), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).