2-(2-aminoethyl)-5-hydroxy-1-(3-phenylphenyl)pyridin-4-one

C19H18N2O2 — CID 118736610

IUPAC2-(2-aminoethyl)-5-hydroxy-1-(3-phenylphenyl)pyridin-4-one
SMILESNCCc1cc(=O)c(O)cn1-c1cccc(-c2ccccc2)c1
InChIInChI=1S/C19H18N2O2/c20-10-9-17-12-18(22)19(23)13-21(17)16-8-4-7-15(11-16)14-5-2-1-3-6-14/h1-8,11-13,23H,9-10,20H2
InChIKeyKGALNCYLPUEOFS-UHFFFAOYSA-N
MW306.37 g/mol
LogP2.71
Rot. Bonds4

About 2-(2-aminoethyl)-5-hydroxy-1-(3-phenylphenyl)pyridin-4-one

2-(2-aminoethyl)-5-hydroxy-1-(3-phenylphenyl)pyridin-4-one (PubChem CID 118736610) has the molecular formula C19H18N2O2 and a molecular weight of 306.37 g/mol. Its IUPAC name is 2-(2-aminoethyl)-5-hydroxy-1-(3-phenylphenyl)pyridin-4-one.

Molecular Properties

Compound Name2-(2-aminoethyl)-5-hydroxy-1-(3-phenylphenyl)pyridin-4-one
PubChem CID118736610
Molecular FormulaC19H18N2O2
Molecular Weight306.37 g/mol
Exact Mass306.14
IUPAC Name2-(2-aminoethyl)-5-hydroxy-1-(3-phenylphenyl)pyridin-4-one
SMILESNCCc1cc(=O)c(O)cn1-c1cccc(-c2ccccc2)c1
InChIInChI=1S/C19H18N2O2/c20-10-9-17-12-18(22)19(23)13-21(17)16-8-4-7-15(11-16)14-5-2-1-3-6-14/h1-8,11-13,23H,9-10,20H2
InChIKeyKGALNCYLPUEOFS-UHFFFAOYSA-N
XLogP2.71
TPSA68.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.37
LogP ≤ 52.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

[1-(Biphenyl-3-yl)-5-hydroxy-4-oxo-1,4-dihydropyridin-3-yl]boronic acid
CID 53379376
1-(Biphenyl-3-Yl)-3-Hydroxypyridin-4(1h)-One
CID 53380912
5-Hydroxy-2-(1-hydroxyethyl)-1-(3-phenylphenyl)pyridin-4-one
CID 53379379
1-biphenyl-3-yl-5-hydroxy-2-methylpyridin-4(1H)-one
CID 67418555
1-(biphenyl-3-yl)-5-hydroxy-2-phenylpyridin-4(1H)-one
CID 67419355
5-Hydroxy-1-(3-phenylphenyl)-2-propan-2-ylpyridin-4-one
CID 69932517
5-Hydroxy-2-(hydroxymethyl)-1-(4-phenylphenyl)pyridin-4-one
CID 118736605
5-Hydroxy-2-(hydroxymethyl)-1-(3-phenylphenyl)pyridin-4-one
CID 118736606
5-Hydroxy-2-(1-hydroxybutyl)-1-(3-phenylphenyl)pyridin-4-one
CID 118736608
5-Hydroxy-2-(1-hydroxy-2-methylpropyl)-1-(3-phenylphenyl)pyridin-4-one
CID 118736609
5-Hydroxy-2-methyl-1-(4-phenylphenyl)pyridin-4-one
CID 130424161
1-(3,5-Dimethylphenyl)-3-hydroxy-2-methylpyridin-4-one
CID 118736603

Frequently Asked Questions

What is the IUPAC name of 2-(2-aminoethyl)-5-hydroxy-1-(3-phenylphenyl)pyridin-4-one?
The IUPAC name of 2-(2-aminoethyl)-5-hydroxy-1-(3-phenylphenyl)pyridin-4-one (CID 118736610) is 2-(2-aminoethyl)-5-hydroxy-1-(3-phenylphenyl)pyridin-4-one.
What is the SMILES notation for 2-(2-aminoethyl)-5-hydroxy-1-(3-phenylphenyl)pyridin-4-one?
The canonical SMILES for 2-(2-aminoethyl)-5-hydroxy-1-(3-phenylphenyl)pyridin-4-one is NCCc1cc(=O)c(O)cn1-c1cccc(-c2ccccc2)c1.
What is the InChIKey of 2-(2-aminoethyl)-5-hydroxy-1-(3-phenylphenyl)pyridin-4-one?
The InChIKey is KGALNCYLPUEOFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N2O2/c20-10-9-17-12-18(22)19(23)13-21(17)16-8-4-7-15(11-16)14-5-2-1-3-6-14/h1-8,11-13,23H,9-10,20H2.
What are the key properties of 2-(2-aminoethyl)-5-hydroxy-1-(3-phenylphenyl)pyridin-4-one?
2-(2-aminoethyl)-5-hydroxy-1-(3-phenylphenyl)pyridin-4-one has a molecular weight of 306.37 g/mol, XLogP of 2.71, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-aminoethyl)-5-hydroxy-1-(3-phenylphenyl)pyridin-4-one is sourced from PubChem (CID 118736610), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).