(2-oxo-1-pyridinyl) naphthalene-1-carboxylate

C16H11NO3 — CID 15527291

IUPAC(2-oxo-1-pyridinyl) naphthalene-1-carboxylate
SMILESO=C(On1ccccc1=O)c1cccc2ccccc12
InChIInChI=1S/C16H11NO3/c18-15-10-3-4-11-17(15)20-16(19)14-9-5-7-12-6-1-2-8-13(12)14/h1-11H
InChIKeyRUBRCVWRSFYBCE-UHFFFAOYSA-N
MW265.27 g/mol
LogP2.27
Rot. Bonds2

About (2-oxo-1-pyridinyl) naphthalene-1-carboxylate

(2-oxo-1-pyridinyl) naphthalene-1-carboxylate (PubChem CID 15527291) has the molecular formula C16H11NO3 and a molecular weight of 265.27 g/mol. Its IUPAC name is (2-oxo-1-pyridinyl) naphthalene-1-carboxylate.

Molecular Properties

Compound Name(2-oxo-1-pyridinyl) naphthalene-1-carboxylate
PubChem CID15527291
Molecular FormulaC16H11NO3
Molecular Weight265.27 g/mol
Exact Mass265.07
IUPAC Name(2-oxo-1-pyridinyl) naphthalene-1-carboxylate
SMILESO=C(On1ccccc1=O)c1cccc2ccccc12
InChIInChI=1S/C16H11NO3/c18-15-10-3-4-11-17(15)20-16(19)14-9-5-7-12-6-1-2-8-13(12)14/h1-11H
InChIKeyRUBRCVWRSFYBCE-UHFFFAOYSA-N
XLogP2.27
TPSA48.30 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.27
LogP ≤ 52.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (2-oxo-1-pyridinyl) naphthalene-1-carboxylate?
The IUPAC name of (2-oxo-1-pyridinyl) naphthalene-1-carboxylate (CID 15527291) is (2-oxo-1-pyridinyl) naphthalene-1-carboxylate.
What is the SMILES notation for (2-oxo-1-pyridinyl) naphthalene-1-carboxylate?
The canonical SMILES for (2-oxo-1-pyridinyl) naphthalene-1-carboxylate is O=C(On1ccccc1=O)c1cccc2ccccc12.
What is the InChIKey of (2-oxo-1-pyridinyl) naphthalene-1-carboxylate?
The InChIKey is RUBRCVWRSFYBCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H11NO3/c18-15-10-3-4-11-17(15)20-16(19)14-9-5-7-12-6-1-2-8-13(12)14/h1-11H.
What are the key properties of (2-oxo-1-pyridinyl) naphthalene-1-carboxylate?
(2-oxo-1-pyridinyl) naphthalene-1-carboxylate has a molecular weight of 265.27 g/mol, XLogP of 2.27, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2-oxo-1-pyridinyl) naphthalene-1-carboxylate is sourced from PubChem (CID 15527291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).