4-methoxy-N-(5-pyridin-2-yl-1H-pyrazol-3-yl)benzamide

C16H14N4O2 — CID 127042816

IUPAC4-methoxy-N-(5-pyridin-2-yl-1H-pyrazol-3-yl)benzamide
SMILESCOc1ccc(C(=O)Nc2cc(-c3ccccn3)[nH]n2)cc1
InChIInChI=1S/C16H14N4O2/c1-22-12-7-5-11(6-8-12)16(21)18-15-10-14(19-20-15)13-4-2-3-9-17-13/h2-10H,1H3,(H2,18,19,20,21)
InChIKeyONOVOWXFNSVYJU-UHFFFAOYSA-N
MW294.31 g/mol
LogP2.73
Rot. Bonds4

About 4-methoxy-N-(5-pyridin-2-yl-1H-pyrazol-3-yl)benzamide

4-methoxy-N-(5-pyridin-2-yl-1H-pyrazol-3-yl)benzamide (PubChem CID 127042816) has the molecular formula C16H14N4O2 and a molecular weight of 294.31 g/mol. Its IUPAC name is 4-methoxy-N-(5-pyridin-2-yl-1H-pyrazol-3-yl)benzamide.

Molecular Properties

Compound Name4-methoxy-N-(5-pyridin-2-yl-1H-pyrazol-3-yl)benzamide
PubChem CID127042816
Molecular FormulaC16H14N4O2
Molecular Weight294.31 g/mol
Exact Mass294.11
IUPAC Name4-methoxy-N-(5-pyridin-2-yl-1H-pyrazol-3-yl)benzamide
SMILESCOc1ccc(C(=O)Nc2cc(-c3ccccn3)[nH]n2)cc1
InChIInChI=1S/C16H14N4O2/c1-22-12-7-5-11(6-8-12)16(21)18-15-10-14(19-20-15)13-4-2-3-9-17-13/h2-10H,1H3,(H2,18,19,20,21)
InChIKeyONOVOWXFNSVYJU-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 4-methoxy-N-(5-pyridin-2-yl-1H-pyrazol-3-yl)benzamide?
The IUPAC name of 4-methoxy-N-(5-pyridin-2-yl-1H-pyrazol-3-yl)benzamide (CID 127042816) is 4-methoxy-N-(5-pyridin-2-yl-1H-pyrazol-3-yl)benzamide.
What is the SMILES notation for 4-methoxy-N-(5-pyridin-2-yl-1H-pyrazol-3-yl)benzamide?
The canonical SMILES for 4-methoxy-N-(5-pyridin-2-yl-1H-pyrazol-3-yl)benzamide is COc1ccc(C(=O)Nc2cc(-c3ccccn3)[nH]n2)cc1.
What is the InChIKey of 4-methoxy-N-(5-pyridin-2-yl-1H-pyrazol-3-yl)benzamide?
The InChIKey is ONOVOWXFNSVYJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N4O2/c1-22-12-7-5-11(6-8-12)16(21)18-15-10-14(19-20-15)13-4-2-3-9-17-13/h2-10H,1H3,(H2,18,19,20,21).
What are the key properties of 4-methoxy-N-(5-pyridin-2-yl-1H-pyrazol-3-yl)benzamide?
4-methoxy-N-(5-pyridin-2-yl-1H-pyrazol-3-yl)benzamide 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 4-methoxy-N-(5-pyridin-2-yl-1H-pyrazol-3-yl)benzamide is sourced from PubChem (CID 127042816), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).