4-(4-fluorophenyl)-N-phenyl-3,6-dihydro-2H-pyridine-1-carboxamide

C18H17FN2O — CID 2980777

IUPAC4-(4-fluorophenyl)-N-phenyl-3,6-dihydro-2H-pyridine-1-carboxamide
SMILESO=C(Nc1ccccc1)N1CC=C(c2ccc(F)cc2)CC1
InChIInChI=1S/C18H17FN2O/c19-16-8-6-14(7-9-16)15-10-12-21(13-11-15)18(22)20-17-4-2-1-3-5-17/h1-10H,11-13H2,(H,20,22)
InChIKeyULSQVGOLWMRPTD-UHFFFAOYSA-N
MW296.35 g/mol
LogP4.15
Rot. Bonds2

About 4-(4-fluorophenyl)-N-phenyl-3,6-dihydro-2H-pyridine-1-carboxamide

4-(4-fluorophenyl)-N-phenyl-3,6-dihydro-2H-pyridine-1-carboxamide (PubChem CID 2980777) has the molecular formula C18H17FN2O and a molecular weight of 296.35 g/mol. Its IUPAC name is 4-(4-fluorophenyl)-N-phenyl-3,6-dihydro-2H-pyridine-1-carboxamide.

Molecular Properties

Compound Name4-(4-fluorophenyl)-N-phenyl-3,6-dihydro-2H-pyridine-1-carboxamide
PubChem CID2980777
Molecular FormulaC18H17FN2O
Molecular Weight296.35 g/mol
Exact Mass296.13
IUPAC Name4-(4-fluorophenyl)-N-phenyl-3,6-dihydro-2H-pyridine-1-carboxamide
SMILESO=C(Nc1ccccc1)N1CC=C(c2ccc(F)cc2)CC1
InChIInChI=1S/C18H17FN2O/c19-16-8-6-14(7-9-16)15-10-12-21(13-11-15)18(22)20-17-4-2-1-3-5-17/h1-10H,11-13H2,(H,20,22)
InChIKeyULSQVGOLWMRPTD-UHFFFAOYSA-N
XLogP4.15
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.35
LogP ≤ 54.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-(4-fluorophenyl)-N-phenyl-3,6-dihydro-2H-pyridine-1-carboxamide?
The IUPAC name of 4-(4-fluorophenyl)-N-phenyl-3,6-dihydro-2H-pyridine-1-carboxamide (CID 2980777) is 4-(4-fluorophenyl)-N-phenyl-3,6-dihydro-2H-pyridine-1-carboxamide.
What is the SMILES notation for 4-(4-fluorophenyl)-N-phenyl-3,6-dihydro-2H-pyridine-1-carboxamide?
The canonical SMILES for 4-(4-fluorophenyl)-N-phenyl-3,6-dihydro-2H-pyridine-1-carboxamide is O=C(Nc1ccccc1)N1CC=C(c2ccc(F)cc2)CC1.
What is the InChIKey of 4-(4-fluorophenyl)-N-phenyl-3,6-dihydro-2H-pyridine-1-carboxamide?
The InChIKey is ULSQVGOLWMRPTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17FN2O/c19-16-8-6-14(7-9-16)15-10-12-21(13-11-15)18(22)20-17-4-2-1-3-5-17/h1-10H,11-13H2,(H,20,22).
What are the key properties of 4-(4-fluorophenyl)-N-phenyl-3,6-dihydro-2H-pyridine-1-carboxamide?
4-(4-fluorophenyl)-N-phenyl-3,6-dihydro-2H-pyridine-1-carboxamide has a molecular weight of 296.35 g/mol, XLogP of 4.15, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-fluorophenyl)-N-phenyl-3,6-dihydro-2H-pyridine-1-carboxamide is sourced from PubChem (CID 2980777), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).