2-methoxy-N-(5-phenyl-1H-pyrazol-3-yl)pyridine-3-carboxamide

C16H14N4O2 — CID 118716972

IUPAC2-methoxy-N-(5-phenyl-1H-pyrazol-3-yl)pyridine-3-carboxamide
SMILESCOc1ncccc1C(=O)Nc1cc(-c2ccccc2)[nH]n1
InChIInChI=1S/C16H14N4O2/c1-22-16-12(8-5-9-17-16)15(21)18-14-10-13(19-20-14)11-6-3-2-4-7-11/h2-10H,1H3,(H2,18,19,20,21)
InChIKeyHMVGLXOATWRELI-UHFFFAOYSA-N
MW294.31 g/mol
LogP2.73
Rot. Bonds4

About 2-methoxy-N-(5-phenyl-1H-pyrazol-3-yl)pyridine-3-carboxamide

2-methoxy-N-(5-phenyl-1H-pyrazol-3-yl)pyridine-3-carboxamide (PubChem CID 118716972) has the molecular formula C16H14N4O2 and a molecular weight of 294.31 g/mol. Its IUPAC name is 2-methoxy-N-(5-phenyl-1H-pyrazol-3-yl)pyridine-3-carboxamide.

Molecular Properties

Compound Name2-methoxy-N-(5-phenyl-1H-pyrazol-3-yl)pyridine-3-carboxamide
PubChem CID118716972
Molecular FormulaC16H14N4O2
Molecular Weight294.31 g/mol
Exact Mass294.11
IUPAC Name2-methoxy-N-(5-phenyl-1H-pyrazol-3-yl)pyridine-3-carboxamide
SMILESCOc1ncccc1C(=O)Nc1cc(-c2ccccc2)[nH]n1
InChIInChI=1S/C16H14N4O2/c1-22-16-12(8-5-9-17-16)15(21)18-14-10-13(19-20-14)11-6-3-2-4-7-11/h2-10H,1H3,(H2,18,19,20,21)
InChIKeyHMVGLXOATWRELI-UHFFFAOYSA-N
XLogP2.73
TPSA79.90 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.31
LogP ≤ 52.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-(5-phenyl-1H-pyrazol-3-yl)pyridine-3-carboxamide?
The IUPAC name of 2-methoxy-N-(5-phenyl-1H-pyrazol-3-yl)pyridine-3-carboxamide (CID 118716972) is 2-methoxy-N-(5-phenyl-1H-pyrazol-3-yl)pyridine-3-carboxamide.
What is the SMILES notation for 2-methoxy-N-(5-phenyl-1H-pyrazol-3-yl)pyridine-3-carboxamide?
The canonical SMILES for 2-methoxy-N-(5-phenyl-1H-pyrazol-3-yl)pyridine-3-carboxamide is COc1ncccc1C(=O)Nc1cc(-c2ccccc2)[nH]n1.
What is the InChIKey of 2-methoxy-N-(5-phenyl-1H-pyrazol-3-yl)pyridine-3-carboxamide?
The InChIKey is HMVGLXOATWRELI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N4O2/c1-22-16-12(8-5-9-17-16)15(21)18-14-10-13(19-20-14)11-6-3-2-4-7-11/h2-10H,1H3,(H2,18,19,20,21).
What are the key properties of 2-methoxy-N-(5-phenyl-1H-pyrazol-3-yl)pyridine-3-carboxamide?
2-methoxy-N-(5-phenyl-1H-pyrazol-3-yl)pyridine-3-carboxamide has a molecular weight of 294.31 g/mol, XLogP of 2.73, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-(5-phenyl-1H-pyrazol-3-yl)pyridine-3-carboxamide is sourced from PubChem (CID 118716972), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).