2-(3-acetamido-2-oxo-1-pyridinyl)-N-propylacetamide

C12H17N3O3 — CID 45272533

IUPAC2-(3-acetamido-2-oxo-1-pyridinyl)-N-propylacetamide
SMILESCCCNC(=O)Cn1cccc(NC(C)=O)c1=O
InChIInChI=1S/C12H17N3O3/c1-3-6-13-11(17)8-15-7-4-5-10(12(15)18)14-9(2)16/h4-5,7H,3,6,8H2,1-2H3,(H,13,17)(H,14,16)
InChIKeyXGCRARNQNMGCAQ-UHFFFAOYSA-N
MW251.29 g/mol
LogP0.33
Rot. Bonds5

About 2-(3-acetamido-2-oxo-1-pyridinyl)-N-propylacetamide

2-(3-acetamido-2-oxo-1-pyridinyl)-N-propylacetamide (PubChem CID 45272533) has the molecular formula C12H17N3O3 and a molecular weight of 251.29 g/mol. Its IUPAC name is 2-(3-acetamido-2-oxo-1-pyridinyl)-N-propylacetamide.

Molecular Properties

Compound Name2-(3-acetamido-2-oxo-1-pyridinyl)-N-propylacetamide
PubChem CID45272533
Molecular FormulaC12H17N3O3
Molecular Weight251.29 g/mol
Exact Mass251.13
IUPAC Name2-(3-acetamido-2-oxo-1-pyridinyl)-N-propylacetamide
SMILESCCCNC(=O)Cn1cccc(NC(C)=O)c1=O
InChIInChI=1S/C12H17N3O3/c1-3-6-13-11(17)8-15-7-4-5-10(12(15)18)14-9(2)16/h4-5,7H,3,6,8H2,1-2H3,(H,13,17)(H,14,16)
InChIKeyXGCRARNQNMGCAQ-UHFFFAOYSA-N
XLogP0.33
TPSA80.20 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.29
LogP ≤ 50.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(5-bromo-1-methyl-2-oxo-3-pyridinyl)propanamide
CID 71860154
Acetamide, N-(4-((2-(dimethylamino)ethyl)amino)-5-oxo-1,3,6-cycloheptatrien-1-yl)-
CID 27342
3-Amino-1-ethyl-1,2-dihydropyridin-2-one
CID 18718035
N-(6-Hydroxypyridin-3-yl)acetamide
CID 4605029
N-(1-Methyl-6-oxo-1,6-dihydropyridin-3-yl)acetamide
CID 61151185
N-(2-hydroxypyridin-3-yl)prop-2-enamide
CID 156600118
Acetamide, N-(4-((2-(diethylamino)ethyl)amino)-5-oxo-1,3,6-cycloheptatrien-1-yl)-
CID 203937
6-hydroxy-N-(propan-2-yl)pyridine-2-carboxamide
CID 15334838
5-Amino-1-(2-(dimethylamino)ethyl)-1,2-dihydropyridin-2-one
CID 20113138
3-Amino-1-(1-methylethyl)-2(1H)-pyridinone
CID 82466688
N-(2,4-dioxo-1,2,3,4-tetrahydro-5-pyrimidinyl)-2,4-hexadienamide
CID 2053608
2-(3-acetamido-2-oxo-1-pyridinyl)-N-(2-hydroxyethyl)acetamide
CID 24769798

Frequently Asked Questions

What is the IUPAC name of 2-(3-acetamido-2-oxo-1-pyridinyl)-N-propylacetamide?
The IUPAC name of 2-(3-acetamido-2-oxo-1-pyridinyl)-N-propylacetamide (CID 45272533) is 2-(3-acetamido-2-oxo-1-pyridinyl)-N-propylacetamide.
What is the SMILES notation for 2-(3-acetamido-2-oxo-1-pyridinyl)-N-propylacetamide?
The canonical SMILES for 2-(3-acetamido-2-oxo-1-pyridinyl)-N-propylacetamide is CCCNC(=O)Cn1cccc(NC(C)=O)c1=O.
What is the InChIKey of 2-(3-acetamido-2-oxo-1-pyridinyl)-N-propylacetamide?
The InChIKey is XGCRARNQNMGCAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N3O3/c1-3-6-13-11(17)8-15-7-4-5-10(12(15)18)14-9(2)16/h4-5,7H,3,6,8H2,1-2H3,(H,13,17)(H,14,16).
What are the key properties of 2-(3-acetamido-2-oxo-1-pyridinyl)-N-propylacetamide?
2-(3-acetamido-2-oxo-1-pyridinyl)-N-propylacetamide has a molecular weight of 251.29 g/mol, XLogP of 0.33, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-acetamido-2-oxo-1-pyridinyl)-N-propylacetamide is sourced from PubChem (CID 45272533), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).