2-[(5-ethyl-6-methyl-2-oxo-1H-pyridin-3-yl)amino]-N-(2-hydroxyphenyl)acetamide

C16H19N3O3 — CID 10040525

IUPAC2-[(5-ethyl-6-methyl-2-oxo-1H-pyridin-3-yl)amino]-N-(2-hydroxyphenyl)acetamide
SMILESCCc1cc(NCC(=O)Nc2ccccc2O)c(=O)[nH]c1C
InChIInChI=1S/C16H19N3O3/c1-3-11-8-13(16(22)18-10(11)2)17-9-15(21)19-12-6-4-5-7-14(12)20/h4-8,17,20H,3,9H2,1-2H3,(H,18,22)(H,19,21)
InChIKeyORJAKQOWNWADOY-UHFFFAOYSA-N
MW301.35 g/mol
LogP2.00
Rot. Bonds5

About 2-[(5-ethyl-6-methyl-2-oxo-1H-pyridin-3-yl)amino]-N-(2-hydroxyphenyl)acetamide

2-[(5-ethyl-6-methyl-2-oxo-1H-pyridin-3-yl)amino]-N-(2-hydroxyphenyl)acetamide (PubChem CID 10040525) has the molecular formula C16H19N3O3 and a molecular weight of 301.35 g/mol. Its IUPAC name is 2-[(5-ethyl-6-methyl-2-oxo-1H-pyridin-3-yl)amino]-N-(2-hydroxyphenyl)acetamide.

Molecular Properties

Compound Name2-[(5-ethyl-6-methyl-2-oxo-1H-pyridin-3-yl)amino]-N-(2-hydroxyphenyl)acetamide
PubChem CID10040525
Molecular FormulaC16H19N3O3
Molecular Weight301.35 g/mol
Exact Mass301.14
IUPAC Name2-[(5-ethyl-6-methyl-2-oxo-1H-pyridin-3-yl)amino]-N-(2-hydroxyphenyl)acetamide
SMILESCCc1cc(NCC(=O)Nc2ccccc2O)c(=O)[nH]c1C
InChIInChI=1S/C16H19N3O3/c1-3-11-8-13(16(22)18-10(11)2)17-9-15(21)19-12-6-4-5-7-14(12)20/h4-8,17,20H,3,9H2,1-2H3,(H,18,22)(H,19,21)
InChIKeyORJAKQOWNWADOY-UHFFFAOYSA-N
XLogP2.00
TPSA94.22 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.35
LogP ≤ 52.00
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'catechol', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-[(5-ethyl-6-methyl-2-oxo-1H-pyridin-3-yl)amino]-N-(2-hydroxyphenyl)acetamide?
The IUPAC name of 2-[(5-ethyl-6-methyl-2-oxo-1H-pyridin-3-yl)amino]-N-(2-hydroxyphenyl)acetamide (CID 10040525) is 2-[(5-ethyl-6-methyl-2-oxo-1H-pyridin-3-yl)amino]-N-(2-hydroxyphenyl)acetamide.
What is the SMILES notation for 2-[(5-ethyl-6-methyl-2-oxo-1H-pyridin-3-yl)amino]-N-(2-hydroxyphenyl)acetamide?
The canonical SMILES for 2-[(5-ethyl-6-methyl-2-oxo-1H-pyridin-3-yl)amino]-N-(2-hydroxyphenyl)acetamide is CCc1cc(NCC(=O)Nc2ccccc2O)c(=O)[nH]c1C.
What is the InChIKey of 2-[(5-ethyl-6-methyl-2-oxo-1H-pyridin-3-yl)amino]-N-(2-hydroxyphenyl)acetamide?
The InChIKey is ORJAKQOWNWADOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O3/c1-3-11-8-13(16(22)18-10(11)2)17-9-15(21)19-12-6-4-5-7-14(12)20/h4-8,17,20H,3,9H2,1-2H3,(H,18,22)(H,19,21).
What are the key properties of 2-[(5-ethyl-6-methyl-2-oxo-1H-pyridin-3-yl)amino]-N-(2-hydroxyphenyl)acetamide?
2-[(5-ethyl-6-methyl-2-oxo-1H-pyridin-3-yl)amino]-N-(2-hydroxyphenyl)acetamide has a molecular weight of 301.35 g/mol, XLogP of 2.00, 5 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(5-ethyl-6-methyl-2-oxo-1H-pyridin-3-yl)amino]-N-(2-hydroxyphenyl)acetamide is sourced from PubChem (CID 10040525), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).