4-naphthalen-1-yloxy-N-(4-oxo-1H-pyridin-3-yl)butanamide

C19H18N2O3 — CID 51118907

IUPAC4-naphthalen-1-yloxy-N-(4-oxo-1H-pyridin-3-yl)butanamide
SMILESO=C(CCCOc1cccc2ccccc12)Nc1c[nH]ccc1=O
InChIInChI=1S/C19H18N2O3/c22-17-10-11-20-13-16(17)21-19(23)9-4-12-24-18-8-3-6-14-5-1-2-7-15(14)18/h1-3,5-8,10-11,13H,4,9,12H2,(H,20,22)(H,21,23)
InChIKeyIFRFTNYQWYXYKO-UHFFFAOYSA-N
MW322.36 g/mol
LogP3.33
Rot. Bonds6

About 4-naphthalen-1-yloxy-N-(4-oxo-1H-pyridin-3-yl)butanamide

4-naphthalen-1-yloxy-N-(4-oxo-1H-pyridin-3-yl)butanamide (PubChem CID 51118907) has the molecular formula C19H18N2O3 and a molecular weight of 322.36 g/mol. Its IUPAC name is 4-naphthalen-1-yloxy-N-(4-oxo-1H-pyridin-3-yl)butanamide.

Molecular Properties

Compound Name4-naphthalen-1-yloxy-N-(4-oxo-1H-pyridin-3-yl)butanamide
PubChem CID51118907
Molecular FormulaC19H18N2O3
Molecular Weight322.36 g/mol
Exact Mass322.13
IUPAC Name4-naphthalen-1-yloxy-N-(4-oxo-1H-pyridin-3-yl)butanamide
SMILESO=C(CCCOc1cccc2ccccc12)Nc1c[nH]ccc1=O
InChIInChI=1S/C19H18N2O3/c22-17-10-11-20-13-16(17)21-19(23)9-4-12-24-18-8-3-6-14-5-1-2-7-15(14)18/h1-3,5-8,10-11,13H,4,9,12H2,(H,20,22)(H,21,23)
InChIKeyIFRFTNYQWYXYKO-UHFFFAOYSA-N
XLogP3.33
TPSA71.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.36
LogP ≤ 53.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-benzyl-4-[(4-oxo-1H-pyridin-3-yl)oxy]butanamide
CID 57066113
N-(3-amino-3-oxopropyl)-2-(4-naphthalen-1-yloxybutanoylamino)benzamide
CID 56573333
N-[1-(2-methylsulfonylethyl)-2-oxo-3-pyridinyl]-4-naphthalen-1-yloxybutanamide
CID 75434277
6-naphthalen-1-yloxyhex-1-en-3-one
CID 134187093
N-[3-(carbamoylamino)phenyl]-4-naphthalen-1-yloxybutanamide
CID 55706773
N-[2-(2-methoxyethoxy)-3-pyridinyl]-4-naphthalen-1-yloxybutanamide
CID 56500250
N-(2-fluoro-5-nitrophenyl)-4-naphthalen-1-yloxybutanamide
CID 60528261
(2S)-2-(4-naphthalen-1-yloxybutanoylamino)propanoic acid
CID 119238607
4-naphthalen-1-yloxy-N-piperidin-4-ylbutanamide
CID 119390244
4-(2,4-dichlorophenoxy)-N-naphthalen-1-ylbutanamide
CID 2177409
N-cyclopropyl-4-(4-naphthalen-1-yloxybutanoylamino)benzamide
CID 55706628
N,N-dimethyl-4-naphthalen-1-yloxybutanamide
CID 60769263

Frequently Asked Questions

What is the IUPAC name of 4-naphthalen-1-yloxy-N-(4-oxo-1H-pyridin-3-yl)butanamide?
The IUPAC name of 4-naphthalen-1-yloxy-N-(4-oxo-1H-pyridin-3-yl)butanamide (CID 51118907) is 4-naphthalen-1-yloxy-N-(4-oxo-1H-pyridin-3-yl)butanamide.
What is the SMILES notation for 4-naphthalen-1-yloxy-N-(4-oxo-1H-pyridin-3-yl)butanamide?
The canonical SMILES for 4-naphthalen-1-yloxy-N-(4-oxo-1H-pyridin-3-yl)butanamide is O=C(CCCOc1cccc2ccccc12)Nc1c[nH]ccc1=O.
What is the InChIKey of 4-naphthalen-1-yloxy-N-(4-oxo-1H-pyridin-3-yl)butanamide?
The InChIKey is IFRFTNYQWYXYKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N2O3/c22-17-10-11-20-13-16(17)21-19(23)9-4-12-24-18-8-3-6-14-5-1-2-7-15(14)18/h1-3,5-8,10-11,13H,4,9,12H2,(H,20,22)(H,21,23).
What are the key properties of 4-naphthalen-1-yloxy-N-(4-oxo-1H-pyridin-3-yl)butanamide?
4-naphthalen-1-yloxy-N-(4-oxo-1H-pyridin-3-yl)butanamide has a molecular weight of 322.36 g/mol, XLogP of 3.33, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-naphthalen-1-yloxy-N-(4-oxo-1H-pyridin-3-yl)butanamide is sourced from PubChem (CID 51118907), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).