10-(2-oxo-1H-pyridin-3-yl)decanoic acid

C15H23NO3 — CID 151173822

IUPAC10-(2-oxo-1H-pyridin-3-yl)decanoic acid
SMILESO=C(O)CCCCCCCCCc1ccc[nH]c1=O
InChIInChI=1S/C15H23NO3/c17-14(18)11-7-5-3-1-2-4-6-9-13-10-8-12-16-15(13)19/h8,10,12H,1-7,9,11H2,(H,16,19)(H,17,18)
InChIKeyNCVQHBLCZCOQDD-UHFFFAOYSA-N
MW265.35 g/mol
LogP3.12
Rot. Bonds10

About 10-(2-oxo-1H-pyridin-3-yl)decanoic acid

10-(2-oxo-1H-pyridin-3-yl)decanoic acid (PubChem CID 151173822) has the molecular formula C15H23NO3 and a molecular weight of 265.35 g/mol. Its IUPAC name is 10-(2-oxo-1H-pyridin-3-yl)decanoic acid.

Molecular Properties

Compound Name10-(2-oxo-1H-pyridin-3-yl)decanoic acid
PubChem CID151173822
Molecular FormulaC15H23NO3
Molecular Weight265.35 g/mol
Exact Mass265.17
IUPAC Name10-(2-oxo-1H-pyridin-3-yl)decanoic acid
SMILESO=C(O)CCCCCCCCCc1ccc[nH]c1=O
InChIInChI=1S/C15H23NO3/c17-14(18)11-7-5-3-1-2-4-6-9-13-10-8-12-16-15(13)19/h8,10,12H,1-7,9,11H2,(H,16,19)(H,17,18)
InChIKeyNCVQHBLCZCOQDD-UHFFFAOYSA-N
XLogP3.12
TPSA70.16 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.35
LogP ≤ 53.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 10-(2-oxo-1H-pyridin-3-yl)decanoic acid?
The IUPAC name of 10-(2-oxo-1H-pyridin-3-yl)decanoic acid (CID 151173822) is 10-(2-oxo-1H-pyridin-3-yl)decanoic acid.
What is the SMILES notation for 10-(2-oxo-1H-pyridin-3-yl)decanoic acid?
The canonical SMILES for 10-(2-oxo-1H-pyridin-3-yl)decanoic acid is O=C(O)CCCCCCCCCc1ccc[nH]c1=O.
What is the InChIKey of 10-(2-oxo-1H-pyridin-3-yl)decanoic acid?
The InChIKey is NCVQHBLCZCOQDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO3/c17-14(18)11-7-5-3-1-2-4-6-9-13-10-8-12-16-15(13)19/h8,10,12H,1-7,9,11H2,(H,16,19)(H,17,18).
What are the key properties of 10-(2-oxo-1H-pyridin-3-yl)decanoic acid?
10-(2-oxo-1H-pyridin-3-yl)decanoic acid has a molecular weight of 265.35 g/mol, XLogP of 3.12, 10 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 10-(2-oxo-1H-pyridin-3-yl)decanoic acid is sourced from PubChem (CID 151173822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).