2-(2-oxo-1-pyridinyl)-N-[(Z)-(2-pentylcyclopent-2-en-1-ylidene)amino]acetamide

C17H23N3O2 — CID 8883649

IUPAC2-(2-oxo-1-pyridinyl)-N-[(Z)-(2-pentylcyclopent-2-en-1-ylidene)amino]acetamide
SMILESCCCCCC1=CCC/C1=N/NC(=O)Cn1ccccc1=O
InChIInChI=1S/C17H23N3O2/c1-2-3-4-8-14-9-7-10-15(14)18-19-16(21)13-20-12-6-5-11-17(20)22/h5-6,9,11-12H,2-4,7-8,10,13H2,1H3,(H,19,21)/b18-15-
InChIKeyAVXVUISUVKKRBI-SDXDJHTJSA-N
MW301.39 g/mol
LogP2.62
Rot. Bonds7

About 2-(2-oxo-1-pyridinyl)-N-[(Z)-(2-pentylcyclopent-2-en-1-ylidene)amino]acetamide

2-(2-oxo-1-pyridinyl)-N-[(Z)-(2-pentylcyclopent-2-en-1-ylidene)amino]acetamide (PubChem CID 8883649) has the molecular formula C17H23N3O2 and a molecular weight of 301.39 g/mol. Its IUPAC name is 2-(2-oxo-1-pyridinyl)-N-[(Z)-(2-pentylcyclopent-2-en-1-ylidene)amino]acetamide.

Molecular Properties

Compound Name2-(2-oxo-1-pyridinyl)-N-[(Z)-(2-pentylcyclopent-2-en-1-ylidene)amino]acetamide
PubChem CID8883649
Molecular FormulaC17H23N3O2
Molecular Weight301.39 g/mol
Exact Mass301.18
IUPAC Name2-(2-oxo-1-pyridinyl)-N-[(Z)-(2-pentylcyclopent-2-en-1-ylidene)amino]acetamide
SMILESCCCCCC1=CCC/C1=N/NC(=O)Cn1ccccc1=O
InChIInChI=1S/C17H23N3O2/c1-2-3-4-8-14-9-7-10-15(14)18-19-16(21)13-20-12-6-5-11-17(20)22/h5-6,9,11-12H,2-4,7-8,10,13H2,1H3,(H,19,21)/b18-15-
InChIKeyAVXVUISUVKKRBI-SDXDJHTJSA-N
XLogP2.62
TPSA63.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.39
LogP ≤ 52.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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

2-(4-fluorophenyl)-N-[(Z)-(2-pentylcyclopent-2-en-1-ylidene)amino]acetamide
CID 7429148
4-oxo-N-[(Z)-(2-pentylcyclopent-2-en-1-ylidene)amino]-3H-phthalazine-1-carboxamide
CID 7912956
N-[(Z)-(6-methoxy-3,4-dihydro-2H-naphthalen-1-ylidene)amino]-2-(2-oxo-1-pyridinyl)acetamide
CID 8883708
2-(2-oxo-1-pyridinyl)-N-[(Z)-1-(4-pentoxyphenyl)ethylideneamino]acetamide
CID 8884023
N-[(Z)-1-(4-methylphenyl)ethylideneamino]-2-(2-oxo-1-pyridinyl)acetamide
CID 8882847
N-(2-methyl-4-oxopentan-3-yl)-2-(2-oxo-1-pyridinyl)acetamide
CID 62018645
methyl 4-[(Z)-[[2-(2-oxo-1-pyridinyl)acetyl]hydrazinylidene]methyl]benzoate
CID 8883336
2-(2-oxo-1-pyridinyl)-N-[(E)-1-(1H-pyrrol-2-yl)ethylideneamino]acetamide
CID 135702535
N-[(Z)-1-(4-iodophenyl)ethylideneamino]-2-(2-oxo-1-pyridinyl)acetamide
CID 8883957
N-[(Z)-1-(2,4-difluorophenyl)ethylideneamino]-2-(2-oxo-1-pyridinyl)acetamide
CID 8884138
2-(2-oxo-1-pyridinyl)-N-[(Z)-thiophen-3-ylmethylideneamino]acetamide
CID 8883298
4-ethyl-N'-[2-(2-oxo-1-pyridinyl)acetyl]benzohydrazide
CID 78791798

Frequently Asked Questions

What is the IUPAC name of 2-(2-oxo-1-pyridinyl)-N-[(Z)-(2-pentylcyclopent-2-en-1-ylidene)amino]acetamide?
The IUPAC name of 2-(2-oxo-1-pyridinyl)-N-[(Z)-(2-pentylcyclopent-2-en-1-ylidene)amino]acetamide (CID 8883649) is 2-(2-oxo-1-pyridinyl)-N-[(Z)-(2-pentylcyclopent-2-en-1-ylidene)amino]acetamide.
What is the SMILES notation for 2-(2-oxo-1-pyridinyl)-N-[(Z)-(2-pentylcyclopent-2-en-1-ylidene)amino]acetamide?
The canonical SMILES for 2-(2-oxo-1-pyridinyl)-N-[(Z)-(2-pentylcyclopent-2-en-1-ylidene)amino]acetamide is CCCCCC1=CCC/C1=N/NC(=O)Cn1ccccc1=O.
What is the InChIKey of 2-(2-oxo-1-pyridinyl)-N-[(Z)-(2-pentylcyclopent-2-en-1-ylidene)amino]acetamide?
The InChIKey is AVXVUISUVKKRBI-SDXDJHTJSA-N. The full InChI is InChI=1S/C17H23N3O2/c1-2-3-4-8-14-9-7-10-15(14)18-19-16(21)13-20-12-6-5-11-17(20)22/h5-6,9,11-12H,2-4,7-8,10,13H2,1H3,(H,19,21)/b18-15-.
What are the key properties of 2-(2-oxo-1-pyridinyl)-N-[(Z)-(2-pentylcyclopent-2-en-1-ylidene)amino]acetamide?
2-(2-oxo-1-pyridinyl)-N-[(Z)-(2-pentylcyclopent-2-en-1-ylidene)amino]acetamide has a molecular weight of 301.39 g/mol, XLogP of 2.62, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-oxo-1-pyridinyl)-N-[(Z)-(2-pentylcyclopent-2-en-1-ylidene)amino]acetamide is sourced from PubChem (CID 8883649), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).