5-[amino(phenyl)methyl]-1-(2-fluorophenyl)-2-methylpyridin-4-one

C19H17FN2O — CID 82421673

IUPAC5-[amino(phenyl)methyl]-1-(2-fluorophenyl)-2-methylpyridin-4-one
SMILESCc1cc(=O)c(C(N)c2ccccc2)cn1-c1ccccc1F
InChIInChI=1S/C19H17FN2O/c1-13-11-18(23)15(19(21)14-7-3-2-4-8-14)12-22(13)17-10-6-5-9-16(17)20/h2-12,19H,21H2,1H3
InChIKeyLNYHYGFNQWMMGF-UHFFFAOYSA-N
MW308.36 g/mol
LogP3.33
Rot. Bonds3

About 5-[amino(phenyl)methyl]-1-(2-fluorophenyl)-2-methylpyridin-4-one

5-[amino(phenyl)methyl]-1-(2-fluorophenyl)-2-methylpyridin-4-one (PubChem CID 82421673) has the molecular formula C19H17FN2O and a molecular weight of 308.36 g/mol. Its IUPAC name is 5-[amino(phenyl)methyl]-1-(2-fluorophenyl)-2-methylpyridin-4-one.

Molecular Properties

Compound Name5-[amino(phenyl)methyl]-1-(2-fluorophenyl)-2-methylpyridin-4-one
PubChem CID82421673
Molecular FormulaC19H17FN2O
Molecular Weight308.36 g/mol
Exact Mass308.13
IUPAC Name5-[amino(phenyl)methyl]-1-(2-fluorophenyl)-2-methylpyridin-4-one
SMILESCc1cc(=O)c(C(N)c2ccccc2)cn1-c1ccccc1F
InChIInChI=1S/C19H17FN2O/c1-13-11-18(23)15(19(21)14-7-3-2-4-8-14)12-22(13)17-10-6-5-9-16(17)20/h2-12,19H,21H2,1H3
InChIKeyLNYHYGFNQWMMGF-UHFFFAOYSA-N
XLogP3.33
TPSA48.02 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.36
LogP ≤ 53.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-(2-amino-1,3-thiazol-4-yl)-1-(2-fluorophenyl)-2-methylpyridin-4-one
CID 82421676
(2-amino-2-oxo-1-phenylethyl) 1-(2-fluorophenyl)-6-methyl-4-oxopyridazine-3-carboxylate
CID 42932351
[3-(2-fluoro-5-methylphenyl)imidazol-4-yl]-phenylmethanamine
CID 114704029
1-(2,4-difluorophenyl)-6-methyl-4-oxopyridine-3-carboxylic acid
CID 82421494
6-methyl-1-(2-methylphenyl)-4-oxopyridine-3-carboxylic acid
CID 82419564
(2-methylphenyl)-phenylmethanamine
CID 15254157
5-amino-1-(2-ethoxyphenyl)-2-methylpyridin-4-one
CID 82467325
5-(2-hydroxypropan-2-yl)-2-methyl-1-(2-methylphenyl)pyridin-4-one
CID 82419586
(2-fluoro-4-methoxyphenyl)-phenylmethanamine
CID 43561220
1-(2,6-difluorophenyl)-6-methyl-4-oxopyridine-3-carbohydrazide
CID 82420817
5-[amino(phenyl)methyl]-6-methyl-1,3-dihydrobenzimidazol-2-one
CID 82174406
7-[amino(phenyl)methyl]-5-fluoro-3-methyl-1,3-dihydroindol-2-one
CID 82173235

Frequently Asked Questions

What is the IUPAC name of 5-[amino(phenyl)methyl]-1-(2-fluorophenyl)-2-methylpyridin-4-one?
The IUPAC name of 5-[amino(phenyl)methyl]-1-(2-fluorophenyl)-2-methylpyridin-4-one (CID 82421673) is 5-[amino(phenyl)methyl]-1-(2-fluorophenyl)-2-methylpyridin-4-one.
What is the SMILES notation for 5-[amino(phenyl)methyl]-1-(2-fluorophenyl)-2-methylpyridin-4-one?
The canonical SMILES for 5-[amino(phenyl)methyl]-1-(2-fluorophenyl)-2-methylpyridin-4-one is Cc1cc(=O)c(C(N)c2ccccc2)cn1-c1ccccc1F.
What is the InChIKey of 5-[amino(phenyl)methyl]-1-(2-fluorophenyl)-2-methylpyridin-4-one?
The InChIKey is LNYHYGFNQWMMGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17FN2O/c1-13-11-18(23)15(19(21)14-7-3-2-4-8-14)12-22(13)17-10-6-5-9-16(17)20/h2-12,19H,21H2,1H3.
What are the key properties of 5-[amino(phenyl)methyl]-1-(2-fluorophenyl)-2-methylpyridin-4-one?
5-[amino(phenyl)methyl]-1-(2-fluorophenyl)-2-methylpyridin-4-one has a molecular weight of 308.36 g/mol, XLogP of 3.33, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[amino(phenyl)methyl]-1-(2-fluorophenyl)-2-methylpyridin-4-one is sourced from PubChem (CID 82421673), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).