6-methyl-4-oxo-N-pyridin-2-yl-1H-pyridine-2-carboxamide;oxane

C17H21N3O3 — CID 144986647

IUPAC6-methyl-4-oxo-N-pyridin-2-yl-1H-pyridine-2-carboxamide;oxane
SMILESC1CCOCC1.Cc1cc(=O)cc(C(=O)Nc2ccccn2)[nH]1
InChIInChI=1S/C12H11N3O2.C5H10O/c1-8-6-9(16)7-10(14-8)12(17)15-11-4-2-3-5-13-11;1-2-4-6-5-3-1/h2-7H,1H3,(H,14,16)(H,13,15,17);1-5H2
InChIKeyWLOIOUIFPLAZHI-UHFFFAOYSA-N
MW315.37 g/mol
LogP2.52
Rot. Bonds2

About 6-methyl-4-oxo-N-pyridin-2-yl-1H-pyridine-2-carboxamide;oxane

6-methyl-4-oxo-N-pyridin-2-yl-1H-pyridine-2-carboxamide;oxane (PubChem CID 144986647) has the molecular formula C17H21N3O3 and a molecular weight of 315.37 g/mol. Its IUPAC name is 6-methyl-4-oxo-N-pyridin-2-yl-1H-pyridine-2-carboxamide;oxane.

Molecular Properties

Compound Name6-methyl-4-oxo-N-pyridin-2-yl-1H-pyridine-2-carboxamide;oxane
PubChem CID144986647
Molecular FormulaC17H21N3O3
Molecular Weight315.37 g/mol
Exact Mass315.16
IUPAC Name6-methyl-4-oxo-N-pyridin-2-yl-1H-pyridine-2-carboxamide;oxane
SMILESC1CCOCC1.Cc1cc(=O)cc(C(=O)Nc2ccccn2)[nH]1
InChIInChI=1S/C12H11N3O2.C5H10O/c1-8-6-9(16)7-10(14-8)12(17)15-11-4-2-3-5-13-11;1-2-4-6-5-3-1/h2-7H,1H3,(H,14,16)(H,13,15,17);1-5H2
InChIKeyWLOIOUIFPLAZHI-UHFFFAOYSA-N
XLogP2.52
TPSA84.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.37
LogP ≤ 52.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-methyl-4-oxo-N-pyridin-2-yl-1H-pyridine-2-carboxamide;oxane?
The IUPAC name of 6-methyl-4-oxo-N-pyridin-2-yl-1H-pyridine-2-carboxamide;oxane (CID 144986647) is 6-methyl-4-oxo-N-pyridin-2-yl-1H-pyridine-2-carboxamide;oxane.
What is the SMILES notation for 6-methyl-4-oxo-N-pyridin-2-yl-1H-pyridine-2-carboxamide;oxane?
The canonical SMILES for 6-methyl-4-oxo-N-pyridin-2-yl-1H-pyridine-2-carboxamide;oxane is C1CCOCC1.Cc1cc(=O)cc(C(=O)Nc2ccccn2)[nH]1.
What is the InChIKey of 6-methyl-4-oxo-N-pyridin-2-yl-1H-pyridine-2-carboxamide;oxane?
The InChIKey is WLOIOUIFPLAZHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11N3O2.C5H10O/c1-8-6-9(16)7-10(14-8)12(17)15-11-4-2-3-5-13-11;1-2-4-6-5-3-1/h2-7H,1H3,(H,14,16)(H,13,15,17);1-5H2.
What are the key properties of 6-methyl-4-oxo-N-pyridin-2-yl-1H-pyridine-2-carboxamide;oxane?
6-methyl-4-oxo-N-pyridin-2-yl-1H-pyridine-2-carboxamide;oxane has a molecular weight of 315.37 g/mol, XLogP of 2.52, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-4-oxo-N-pyridin-2-yl-1H-pyridine-2-carboxamide;oxane is sourced from PubChem (CID 144986647), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).