6-methyl-5-(5-methylfuran-2-yl)-4-oxo-1H-pyridine-3-carboxamide

C12H12N2O3 — CID 175390109

IUPAC6-methyl-5-(5-methylfuran-2-yl)-4-oxo-1H-pyridine-3-carboxamide
SMILESCc1ccc(-c2c(C)[nH]cc(C(N)=O)c2=O)o1
InChIInChI=1S/C12H12N2O3/c1-6-3-4-9(17-6)10-7(2)14-5-8(11(10)15)12(13)16/h3-5H,1-2H3,(H2,13,16)(H,14,15)
InChIKeyPIZJXNJKCQWNHR-UHFFFAOYSA-N
MW232.24 g/mol
LogP1.35
Rot. Bonds2

About 6-methyl-5-(5-methylfuran-2-yl)-4-oxo-1H-pyridine-3-carboxamide

6-methyl-5-(5-methylfuran-2-yl)-4-oxo-1H-pyridine-3-carboxamide (PubChem CID 175390109) has the molecular formula C12H12N2O3 and a molecular weight of 232.24 g/mol. Its IUPAC name is 6-methyl-5-(5-methylfuran-2-yl)-4-oxo-1H-pyridine-3-carboxamide.

Molecular Properties

Compound Name6-methyl-5-(5-methylfuran-2-yl)-4-oxo-1H-pyridine-3-carboxamide
PubChem CID175390109
Molecular FormulaC12H12N2O3
Molecular Weight232.24 g/mol
Exact Mass232.08
IUPAC Name6-methyl-5-(5-methylfuran-2-yl)-4-oxo-1H-pyridine-3-carboxamide
SMILESCc1ccc(-c2c(C)[nH]cc(C(N)=O)c2=O)o1
InChIInChI=1S/C12H12N2O3/c1-6-3-4-9(17-6)10-7(2)14-5-8(11(10)15)12(13)16/h3-5H,1-2H3,(H2,13,16)(H,14,15)
InChIKeyPIZJXNJKCQWNHR-UHFFFAOYSA-N
XLogP1.35
TPSA89.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.24
LogP ≤ 51.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-methyl-5-(5-methylfuran-2-yl)-4-oxo-1H-pyridine-3-carboxamide?
The IUPAC name of 6-methyl-5-(5-methylfuran-2-yl)-4-oxo-1H-pyridine-3-carboxamide (CID 175390109) is 6-methyl-5-(5-methylfuran-2-yl)-4-oxo-1H-pyridine-3-carboxamide.
What is the SMILES notation for 6-methyl-5-(5-methylfuran-2-yl)-4-oxo-1H-pyridine-3-carboxamide?
The canonical SMILES for 6-methyl-5-(5-methylfuran-2-yl)-4-oxo-1H-pyridine-3-carboxamide is Cc1ccc(-c2c(C)[nH]cc(C(N)=O)c2=O)o1.
What is the InChIKey of 6-methyl-5-(5-methylfuran-2-yl)-4-oxo-1H-pyridine-3-carboxamide?
The InChIKey is PIZJXNJKCQWNHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N2O3/c1-6-3-4-9(17-6)10-7(2)14-5-8(11(10)15)12(13)16/h3-5H,1-2H3,(H2,13,16)(H,14,15).
What are the key properties of 6-methyl-5-(5-methylfuran-2-yl)-4-oxo-1H-pyridine-3-carboxamide?
6-methyl-5-(5-methylfuran-2-yl)-4-oxo-1H-pyridine-3-carboxamide has a molecular weight of 232.24 g/mol, XLogP of 1.35, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-5-(5-methylfuran-2-yl)-4-oxo-1H-pyridine-3-carboxamide is sourced from PubChem (CID 175390109), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).