3-(4-acetamidophenoxy)-2-hydroxy-2-methyl-N-pyridin-2-ylpropanamide

C17H19N3O4 — CID 58860966

IUPAC3-(4-acetamidophenoxy)-2-hydroxy-2-methyl-N-pyridin-2-ylpropanamide
SMILESCC(=O)Nc1ccc(OCC(C)(O)C(=O)Nc2ccccn2)cc1
InChIInChI=1S/C17H19N3O4/c1-12(21)19-13-6-8-14(9-7-13)24-11-17(2,23)16(22)20-15-5-3-4-10-18-15/h3-10,23H,11H2,1-2H3,(H,19,21)(H,18,20,22)
InChIKeyCPKVMWDSJBZBIF-UHFFFAOYSA-N
MW329.36 g/mol
LogP1.81
Rot. Bonds6

About 3-(4-acetamidophenoxy)-2-hydroxy-2-methyl-N-pyridin-2-ylpropanamide

3-(4-acetamidophenoxy)-2-hydroxy-2-methyl-N-pyridin-2-ylpropanamide (PubChem CID 58860966) has the molecular formula C17H19N3O4 and a molecular weight of 329.36 g/mol. Its IUPAC name is 3-(4-acetamidophenoxy)-2-hydroxy-2-methyl-N-pyridin-2-ylpropanamide.

Molecular Properties

Compound Name3-(4-acetamidophenoxy)-2-hydroxy-2-methyl-N-pyridin-2-ylpropanamide
PubChem CID58860966
Molecular FormulaC17H19N3O4
Molecular Weight329.36 g/mol
Exact Mass329.14
IUPAC Name3-(4-acetamidophenoxy)-2-hydroxy-2-methyl-N-pyridin-2-ylpropanamide
SMILESCC(=O)Nc1ccc(OCC(C)(O)C(=O)Nc2ccccn2)cc1
InChIInChI=1S/C17H19N3O4/c1-12(21)19-13-6-8-14(9-7-13)24-11-17(2,23)16(22)20-15-5-3-4-10-18-15/h3-10,23H,11H2,1-2H3,(H,19,21)(H,18,20,22)
InChIKeyCPKVMWDSJBZBIF-UHFFFAOYSA-N
XLogP1.81
TPSA100.55 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.36
LogP ≤ 51.81
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

(2S)-2-hydroxy-2-methyl-3-(4-methylphenoxy)-N-(4-methylphenyl)propanamide
CID 58594527
2-hydroxy-2-methyl-3-(4-methylphenoxy)-N-(4-methylphenyl)propanamide
CID 23596876
N-[4-(2-hydroxy-2-methylpropoxy)phenyl]acetamide
CID 60879910
N-[4-[3-(4-acetamidophenoxy)-2-[(4-acetamidophenoxy)methyl]-2-hydroxypropoxy]phenyl]acetamide;hydrate
CID 139075586
2-hydroxy-2-methyl-3-[4-(pentafluoro-λ6-sulfanyl)phenoxy]-N-[4-(pentafluoro-λ6-sulfanyl)phenyl]propanamide
CID 155532276
3-(4-acetamidophenoxy)-N-(4-cyano-3-iodophenyl)-2-hydroxy-2-methylpropanamide
CID 143036854
methyl 2,2-dimethyl-3-oxo-3-(pyridin-2-ylamino)propanoate
CID 115174756
N-(4-tert-butylphenyl)-N'-pyridin-2-yloxamide
CID 108525928
(2S)-N-(4-cyanophenyl)-3-(4-fluorophenoxy)-2-hydroxy-2-methylpropanamide
CID 142885777
3,3,3-trifluoro-N-pyridin-2-yl-2,2-bis(trifluoromethyl)propanamide
CID 71672608
2-hydroxy-2-methyl-N-[4-methyl-3-(trifluoromethyl)phenyl]-3-phenoxypropanamide
CID 23572084
2-cyano-2-methyl-N-pyridin-2-ylpropanamide
CID 60778942

Frequently Asked Questions

What is the IUPAC name of 3-(4-acetamidophenoxy)-2-hydroxy-2-methyl-N-pyridin-2-ylpropanamide?
The IUPAC name of 3-(4-acetamidophenoxy)-2-hydroxy-2-methyl-N-pyridin-2-ylpropanamide (CID 58860966) is 3-(4-acetamidophenoxy)-2-hydroxy-2-methyl-N-pyridin-2-ylpropanamide.
What is the SMILES notation for 3-(4-acetamidophenoxy)-2-hydroxy-2-methyl-N-pyridin-2-ylpropanamide?
The canonical SMILES for 3-(4-acetamidophenoxy)-2-hydroxy-2-methyl-N-pyridin-2-ylpropanamide is CC(=O)Nc1ccc(OCC(C)(O)C(=O)Nc2ccccn2)cc1.
What is the InChIKey of 3-(4-acetamidophenoxy)-2-hydroxy-2-methyl-N-pyridin-2-ylpropanamide?
The InChIKey is CPKVMWDSJBZBIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3O4/c1-12(21)19-13-6-8-14(9-7-13)24-11-17(2,23)16(22)20-15-5-3-4-10-18-15/h3-10,23H,11H2,1-2H3,(H,19,21)(H,18,20,22).
What are the key properties of 3-(4-acetamidophenoxy)-2-hydroxy-2-methyl-N-pyridin-2-ylpropanamide?
3-(4-acetamidophenoxy)-2-hydroxy-2-methyl-N-pyridin-2-ylpropanamide has a molecular weight of 329.36 g/mol, XLogP of 1.81, 6 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-acetamidophenoxy)-2-hydroxy-2-methyl-N-pyridin-2-ylpropanamide is sourced from PubChem (CID 58860966), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).