2-[[1-(3-hydroxypropyl)-2-oxo-3-pyridinyl]oxy]-N-phenylacetamide

C16H18N2O4 — CID 82150868

IUPAC2-[[1-(3-hydroxypropyl)-2-oxo-3-pyridinyl]oxy]-N-phenylacetamide
SMILESO=C(COc1cccn(CCCO)c1=O)Nc1ccccc1
InChIInChI=1S/C16H18N2O4/c19-11-5-10-18-9-4-8-14(16(18)21)22-12-15(20)17-13-6-2-1-3-7-13/h1-4,6-9,19H,5,10-12H2,(H,17,20)
InChIKeyOBDCRJAVCIJKHZ-UHFFFAOYSA-N
MW302.33 g/mol
LogP1.25
Rot. Bonds7

About 2-[[1-(3-hydroxypropyl)-2-oxo-3-pyridinyl]oxy]-N-phenylacetamide

2-[[1-(3-hydroxypropyl)-2-oxo-3-pyridinyl]oxy]-N-phenylacetamide (PubChem CID 82150868) has the molecular formula C16H18N2O4 and a molecular weight of 302.33 g/mol. Its IUPAC name is 2-[[1-(3-hydroxypropyl)-2-oxo-3-pyridinyl]oxy]-N-phenylacetamide.

Molecular Properties

Compound Name2-[[1-(3-hydroxypropyl)-2-oxo-3-pyridinyl]oxy]-N-phenylacetamide
PubChem CID82150868
Molecular FormulaC16H18N2O4
Molecular Weight302.33 g/mol
Exact Mass302.13
IUPAC Name2-[[1-(3-hydroxypropyl)-2-oxo-3-pyridinyl]oxy]-N-phenylacetamide
SMILESO=C(COc1cccn(CCCO)c1=O)Nc1ccccc1
InChIInChI=1S/C16H18N2O4/c19-11-5-10-18-9-4-8-14(16(18)21)22-12-15(20)17-13-6-2-1-3-7-13/h1-4,6-9,19H,5,10-12H2,(H,17,20)
InChIKeyOBDCRJAVCIJKHZ-UHFFFAOYSA-N
XLogP1.25
TPSA80.56 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.33
LogP ≤ 51.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-[[1-(3-amino-3-iminopropyl)-2-oxo-3-pyridinyl]oxy]-N-phenylacetamide
CID 83967823
N-butyl-2-[[1-(3-hydroxypropyl)-2-oxo-3-pyridinyl]oxy]acetamide
CID 82150874
2-(2-methyl-1-oxoisoquinolin-5-yl)oxy-N-phenylacetamide
CID 7293077
2-[[1-(3-aminopropyl)-2-oxo-3-pyridinyl]oxy]-N-propylacetamide
CID 82056289
2-(2-chlorophenoxy)-N-phenylacetamide
CID 853450
2-[[1-(3-aminopropyl)-2-oxo-3-pyridinyl]oxy]-N-butylacetamide
CID 82056257
2-[2-[(E)-(1-methyl-2,5-dioxoimidazolidin-4-ylidene)methyl]phenoxy]-N-phenylacetamide
CID 6520725
1-(3-aminopropyl)-3-phenylmethoxypyridin-2-one
CID 52921436
2-(2-anilino-2-oxoethoxy)-6-chlorobenzoic acid
CID 78975129
2-[5-bromo-4-(hydroxymethyl)-2-methoxyphenoxy]-N-phenylacetamide
CID 19621791
2-[[1-(4-aminobutyl)-2-oxo-3-pyridinyl]oxy]-N,N-diethylacetamide
CID 82143309
4-[[2-(2-propan-2-ylphenoxy)acetyl]amino]benzoic acid
CID 19165036

Frequently Asked Questions

What is the IUPAC name of 2-[[1-(3-hydroxypropyl)-2-oxo-3-pyridinyl]oxy]-N-phenylacetamide?
The IUPAC name of 2-[[1-(3-hydroxypropyl)-2-oxo-3-pyridinyl]oxy]-N-phenylacetamide (CID 82150868) is 2-[[1-(3-hydroxypropyl)-2-oxo-3-pyridinyl]oxy]-N-phenylacetamide.
What is the SMILES notation for 2-[[1-(3-hydroxypropyl)-2-oxo-3-pyridinyl]oxy]-N-phenylacetamide?
The canonical SMILES for 2-[[1-(3-hydroxypropyl)-2-oxo-3-pyridinyl]oxy]-N-phenylacetamide is O=C(COc1cccn(CCCO)c1=O)Nc1ccccc1.
What is the InChIKey of 2-[[1-(3-hydroxypropyl)-2-oxo-3-pyridinyl]oxy]-N-phenylacetamide?
The InChIKey is OBDCRJAVCIJKHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O4/c19-11-5-10-18-9-4-8-14(16(18)21)22-12-15(20)17-13-6-2-1-3-7-13/h1-4,6-9,19H,5,10-12H2,(H,17,20).
What are the key properties of 2-[[1-(3-hydroxypropyl)-2-oxo-3-pyridinyl]oxy]-N-phenylacetamide?
2-[[1-(3-hydroxypropyl)-2-oxo-3-pyridinyl]oxy]-N-phenylacetamide has a molecular weight of 302.33 g/mol, XLogP of 1.25, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[1-(3-hydroxypropyl)-2-oxo-3-pyridinyl]oxy]-N-phenylacetamide is sourced from PubChem (CID 82150868), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).