N-(5-hydroxynaphthalen-1-yl)-6-oxo-1H-pyridine-3-carboxamide

C16H12N2O3 — CID 60654350

IUPACN-(5-hydroxynaphthalen-1-yl)-6-oxo-1H-pyridine-3-carboxamide
SMILESO=C(Nc1cccc2c(O)cccc12)c1ccc(=O)[nH]c1
InChIInChI=1S/C16H12N2O3/c19-14-6-2-3-11-12(14)4-1-5-13(11)18-16(21)10-7-8-15(20)17-9-10/h1-9,19H,(H,17,20)(H,18,21)
InChIKeyWXWKXTCZWPHDOD-UHFFFAOYSA-N
MW280.28 g/mol
LogP2.49
Rot. Bonds2

About N-(5-hydroxynaphthalen-1-yl)-6-oxo-1H-pyridine-3-carboxamide

N-(5-hydroxynaphthalen-1-yl)-6-oxo-1H-pyridine-3-carboxamide (PubChem CID 60654350) has the molecular formula C16H12N2O3 and a molecular weight of 280.28 g/mol. Its IUPAC name is N-(5-hydroxynaphthalen-1-yl)-6-oxo-1H-pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(5-hydroxynaphthalen-1-yl)-6-oxo-1H-pyridine-3-carboxamide
PubChem CID60654350
Molecular FormulaC16H12N2O3
Molecular Weight280.28 g/mol
Exact Mass280.08
IUPAC NameN-(5-hydroxynaphthalen-1-yl)-6-oxo-1H-pyridine-3-carboxamide
SMILESO=C(Nc1cccc2c(O)cccc12)c1ccc(=O)[nH]c1
InChIInChI=1S/C16H12N2O3/c19-14-6-2-3-11-12(14)4-1-5-13(11)18-16(21)10-7-8-15(20)17-9-10/h1-9,19H,(H,17,20)(H,18,21)
InChIKeyWXWKXTCZWPHDOD-UHFFFAOYSA-N
XLogP2.49
TPSA82.19 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.28
LogP ≤ 52.49
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(5-hydroxynaphthalen-1-yl)-6-oxo-1H-pyridine-3-carboxamide?
The IUPAC name of N-(5-hydroxynaphthalen-1-yl)-6-oxo-1H-pyridine-3-carboxamide (CID 60654350) is N-(5-hydroxynaphthalen-1-yl)-6-oxo-1H-pyridine-3-carboxamide.
What is the SMILES notation for N-(5-hydroxynaphthalen-1-yl)-6-oxo-1H-pyridine-3-carboxamide?
The canonical SMILES for N-(5-hydroxynaphthalen-1-yl)-6-oxo-1H-pyridine-3-carboxamide is O=C(Nc1cccc2c(O)cccc12)c1ccc(=O)[nH]c1.
What is the InChIKey of N-(5-hydroxynaphthalen-1-yl)-6-oxo-1H-pyridine-3-carboxamide?
The InChIKey is WXWKXTCZWPHDOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12N2O3/c19-14-6-2-3-11-12(14)4-1-5-13(11)18-16(21)10-7-8-15(20)17-9-10/h1-9,19H,(H,17,20)(H,18,21).
What are the key properties of N-(5-hydroxynaphthalen-1-yl)-6-oxo-1H-pyridine-3-carboxamide?
N-(5-hydroxynaphthalen-1-yl)-6-oxo-1H-pyridine-3-carboxamide has a molecular weight of 280.28 g/mol, XLogP of 2.49, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-hydroxynaphthalen-1-yl)-6-oxo-1H-pyridine-3-carboxamide is sourced from PubChem (CID 60654350), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).