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

C19H19FN2O — CID 20929932

IUPAC1-[(2-fluorophenyl)methyl]-N-phenyl-3,6-dihydro-2H-pyridine-4-carboxamide
SMILESO=C(Nc1ccccc1)C1=CCN(Cc2ccccc2F)CC1
InChIInChI=1S/C19H19FN2O/c20-18-9-5-4-6-16(18)14-22-12-10-15(11-13-22)19(23)21-17-7-2-1-3-8-17/h1-10H,11-14H2,(H,21,23)
InChIKeyBSYPWUHZPGNGNM-UHFFFAOYSA-N
MW310.37 g/mol
LogP3.60
Rot. Bonds4

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

1-[(2-fluorophenyl)methyl]-N-phenyl-3,6-dihydro-2H-pyridine-4-carboxamide (PubChem CID 20929932) has the molecular formula C19H19FN2O and a molecular weight of 310.37 g/mol. Its IUPAC name is 1-[(2-fluorophenyl)methyl]-N-phenyl-3,6-dihydro-2H-pyridine-4-carboxamide.

Molecular Properties

Compound Name1-[(2-fluorophenyl)methyl]-N-phenyl-3,6-dihydro-2H-pyridine-4-carboxamide
PubChem CID20929932
Molecular FormulaC19H19FN2O
Molecular Weight310.37 g/mol
Exact Mass310.15
IUPAC Name1-[(2-fluorophenyl)methyl]-N-phenyl-3,6-dihydro-2H-pyridine-4-carboxamide
SMILESO=C(Nc1ccccc1)C1=CCN(Cc2ccccc2F)CC1
InChIInChI=1S/C19H19FN2O/c20-18-9-5-4-6-16(18)14-22-12-10-15(11-13-22)19(23)21-17-7-2-1-3-8-17/h1-10H,11-14H2,(H,21,23)
InChIKeyBSYPWUHZPGNGNM-UHFFFAOYSA-N
XLogP3.60
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.37
LogP ≤ 53.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(4-chlorophenyl)-1-[(2-fluorophenyl)methyl]-3,6-dihydro-2H-pyridine-4-carboxamide
CID 20929929
N-[(2-fluorophenyl)methyl]-1-[(3-fluorophenyl)methyl]-3,6-dihydro-2H-pyridine-4-carboxamide
CID 53051250
2-[4-[(2-fluorophenyl)methyl]piperazin-1-yl]-N-phenylpropanamide
CID 46802310
1-[(4-fluorophenyl)methyl]-N-(3-methoxyphenyl)-3,6-dihydro-2H-pyridine-4-carboxamide
CID 20929937
1-[(2-fluorophenyl)methyl]azepane;oxalic acid
CID 163328098
1-[(3-methylphenyl)methyl]-N-(3-methylsulfanylphenyl)-3,6-dihydro-2H-pyridine-4-carboxamide
CID 53051194
2-[4-[(2-fluorophenyl)methyl]piperazin-1-yl]-2-oxoacetic acid
CID 82122743
1-[(4-chlorophenyl)methyl]-N-(3,5-dimethoxyphenyl)-3,6-dihydro-2H-pyridine-4-carboxamide
CID 20929946
2-(2-fluorophenyl)-4-[(2-fluorophenyl)methyl]-3,5-dioxo-N-phenyl-1,2,4-triazine-6-carboxamide
CID 42835694
1-[(2-fluorophenyl)methyl]-6-oxo-N-phenylpyridazine-3-carboxamide
CID 26845028
N-[(2-bromophenyl)methyl]-1-[(3-fluorophenyl)methyl]-3,6-dihydro-2H-pyridine-4-carboxamide
CID 53051281
N-[1-[(2-fluorophenyl)methyl]piperidin-3-yl]cyclopentene-1-carboxamide
CID 45185934

Frequently Asked Questions

What is the IUPAC name of 1-[(2-fluorophenyl)methyl]-N-phenyl-3,6-dihydro-2H-pyridine-4-carboxamide?
The IUPAC name of 1-[(2-fluorophenyl)methyl]-N-phenyl-3,6-dihydro-2H-pyridine-4-carboxamide (CID 20929932) is 1-[(2-fluorophenyl)methyl]-N-phenyl-3,6-dihydro-2H-pyridine-4-carboxamide.
What is the SMILES notation for 1-[(2-fluorophenyl)methyl]-N-phenyl-3,6-dihydro-2H-pyridine-4-carboxamide?
The canonical SMILES for 1-[(2-fluorophenyl)methyl]-N-phenyl-3,6-dihydro-2H-pyridine-4-carboxamide is O=C(Nc1ccccc1)C1=CCN(Cc2ccccc2F)CC1.
What is the InChIKey of 1-[(2-fluorophenyl)methyl]-N-phenyl-3,6-dihydro-2H-pyridine-4-carboxamide?
The InChIKey is BSYPWUHZPGNGNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19FN2O/c20-18-9-5-4-6-16(18)14-22-12-10-15(11-13-22)19(23)21-17-7-2-1-3-8-17/h1-10H,11-14H2,(H,21,23).
What are the key properties of 1-[(2-fluorophenyl)methyl]-N-phenyl-3,6-dihydro-2H-pyridine-4-carboxamide?
1-[(2-fluorophenyl)methyl]-N-phenyl-3,6-dihydro-2H-pyridine-4-carboxamide has a molecular weight of 310.37 g/mol, XLogP of 3.60, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2-fluorophenyl)methyl]-N-phenyl-3,6-dihydro-2H-pyridine-4-carboxamide is sourced from PubChem (CID 20929932), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).