2-(2-oxo-1-pyridinyl)-N-[(Z)-1-(4-pentoxyphenyl)ethylideneamino]acetamide

C20H25N3O3 — CID 8884023

IUPAC2-(2-oxo-1-pyridinyl)-N-[(Z)-1-(4-pentoxyphenyl)ethylideneamino]acetamide
SMILESCCCCCOc1ccc(/C(C)=N\NC(=O)Cn2ccccc2=O)cc1
InChIInChI=1S/C20H25N3O3/c1-3-4-7-14-26-18-11-9-17(10-12-18)16(2)21-22-19(24)15-23-13-6-5-8-20(23)25/h5-6,8-13H,3-4,7,14-15H2,1-2H3,(H,22,24)/b21-16-
InChIKeyUGJHXMZKRMCDTK-PGMHBOJBSA-N
MW355.44 g/mol
LogP2.96
Rot. Bonds9

About 2-(2-oxo-1-pyridinyl)-N-[(Z)-1-(4-pentoxyphenyl)ethylideneamino]acetamide

2-(2-oxo-1-pyridinyl)-N-[(Z)-1-(4-pentoxyphenyl)ethylideneamino]acetamide (PubChem CID 8884023) has the molecular formula C20H25N3O3 and a molecular weight of 355.44 g/mol. Its IUPAC name is 2-(2-oxo-1-pyridinyl)-N-[(Z)-1-(4-pentoxyphenyl)ethylideneamino]acetamide.

Molecular Properties

Compound Name2-(2-oxo-1-pyridinyl)-N-[(Z)-1-(4-pentoxyphenyl)ethylideneamino]acetamide
PubChem CID8884023
Molecular FormulaC20H25N3O3
Molecular Weight355.44 g/mol
Exact Mass355.19
IUPAC Name2-(2-oxo-1-pyridinyl)-N-[(Z)-1-(4-pentoxyphenyl)ethylideneamino]acetamide
SMILESCCCCCOc1ccc(/C(C)=N\NC(=O)Cn2ccccc2=O)cc1
InChIInChI=1S/C20H25N3O3/c1-3-4-7-14-26-18-11-9-17(10-12-18)16(2)21-22-19(24)15-23-13-6-5-8-20(23)25/h5-6,8-13H,3-4,7,14-15H2,1-2H3,(H,22,24)/b21-16-
InChIKeyUGJHXMZKRMCDTK-PGMHBOJBSA-N
XLogP2.96
TPSA72.69 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.44
LogP ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-[(Z)-1-(4-methylphenyl)ethylideneamino]-2-(2-oxo-1-pyridinyl)acetamide
CID 8882847
N-[(Z)-1-(4-iodophenyl)ethylideneamino]-2-(2-oxo-1-pyridinyl)acetamide
CID 8883957
N'-[(Z)-1-(4-pentoxyphenyl)ethylideneamino]oxamide
CID 9120798
N-[(E)-1-(2-hydroxy-5-methoxyphenyl)ethylideneamino]-2-(2-oxo-1-pyridinyl)acetamide
CID 135702556
2-(2-oxo-1-pyridinyl)-N-[(Z)-1-(4-piperidin-1-ylsulfonylphenyl)ethylideneamino]acetamide
CID 8883829
2-(2-oxo-1-pyridinyl)-N-[(E)-1-(1H-pyrrol-2-yl)ethylideneamino]acetamide
CID 135702535
N-[1-(4-ethoxyphenyl)ethylideneamino]heptanamide
CID 3694468
N-[(E)-1-(4-ethoxyphenyl)ethylideneamino]-2-(N-methylanilino)acetamide
CID 171978970
[(Z)-1-(4-nonoxyphenyl)ethylideneamino]thiourea
CID 6242832
1-[2-(4-acetylphenoxy)ethyl]pyridin-2-one
CID 78986348
N-[(Z)-1-(5-chlorothiophen-2-yl)ethylideneamino]-2-(2-oxo-1-pyridinyl)acetamide
CID 8883245
2-(3,5-dimethylpyrazol-1-yl)-N-[1-(4-propoxyphenyl)ethylideneamino]acetamide
CID 78600372

Frequently Asked Questions

What is the IUPAC name of 2-(2-oxo-1-pyridinyl)-N-[(Z)-1-(4-pentoxyphenyl)ethylideneamino]acetamide?
The IUPAC name of 2-(2-oxo-1-pyridinyl)-N-[(Z)-1-(4-pentoxyphenyl)ethylideneamino]acetamide (CID 8884023) is 2-(2-oxo-1-pyridinyl)-N-[(Z)-1-(4-pentoxyphenyl)ethylideneamino]acetamide.
What is the SMILES notation for 2-(2-oxo-1-pyridinyl)-N-[(Z)-1-(4-pentoxyphenyl)ethylideneamino]acetamide?
The canonical SMILES for 2-(2-oxo-1-pyridinyl)-N-[(Z)-1-(4-pentoxyphenyl)ethylideneamino]acetamide is CCCCCOc1ccc(/C(C)=N\NC(=O)Cn2ccccc2=O)cc1.
What is the InChIKey of 2-(2-oxo-1-pyridinyl)-N-[(Z)-1-(4-pentoxyphenyl)ethylideneamino]acetamide?
The InChIKey is UGJHXMZKRMCDTK-PGMHBOJBSA-N. The full InChI is InChI=1S/C20H25N3O3/c1-3-4-7-14-26-18-11-9-17(10-12-18)16(2)21-22-19(24)15-23-13-6-5-8-20(23)25/h5-6,8-13H,3-4,7,14-15H2,1-2H3,(H,22,24)/b21-16-.
What are the key properties of 2-(2-oxo-1-pyridinyl)-N-[(Z)-1-(4-pentoxyphenyl)ethylideneamino]acetamide?
2-(2-oxo-1-pyridinyl)-N-[(Z)-1-(4-pentoxyphenyl)ethylideneamino]acetamide has a molecular weight of 355.44 g/mol, XLogP of 2.96, 9 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-oxo-1-pyridinyl)-N-[(Z)-1-(4-pentoxyphenyl)ethylideneamino]acetamide is sourced from PubChem (CID 8884023), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).