2-methoxy-4-(1-pyridin-2-ylpyrazol-4-yl)benzamide

C16H14N4O2 — CID 167872524

IUPAC2-methoxy-4-(1-pyridin-2-ylpyrazol-4-yl)benzamide
SMILESCOc1cc(-c2cnn(-c3ccccn3)c2)ccc1C(N)=O
InChIInChI=1S/C16H14N4O2/c1-22-14-8-11(5-6-13(14)16(17)21)12-9-19-20(10-12)15-4-2-3-7-18-15/h2-10H,1H3,(H2,17,21)
InChIKeyXCMLCPGQNZLYHR-UHFFFAOYSA-N
MW294.31 g/mol
LogP2.04
Rot. Bonds4

About 2-methoxy-4-(1-pyridin-2-ylpyrazol-4-yl)benzamide

2-methoxy-4-(1-pyridin-2-ylpyrazol-4-yl)benzamide (PubChem CID 167872524) has the molecular formula C16H14N4O2 and a molecular weight of 294.31 g/mol. Its IUPAC name is 2-methoxy-4-(1-pyridin-2-ylpyrazol-4-yl)benzamide.

Molecular Properties

Compound Name2-methoxy-4-(1-pyridin-2-ylpyrazol-4-yl)benzamide
PubChem CID167872524
Molecular FormulaC16H14N4O2
Molecular Weight294.31 g/mol
Exact Mass294.11
IUPAC Name2-methoxy-4-(1-pyridin-2-ylpyrazol-4-yl)benzamide
SMILESCOc1cc(-c2cnn(-c3ccccn3)c2)ccc1C(N)=O
InChIInChI=1S/C16H14N4O2/c1-22-14-8-11(5-6-13(14)16(17)21)12-9-19-20(10-12)15-4-2-3-7-18-15/h2-10H,1H3,(H2,17,21)
InChIKeyXCMLCPGQNZLYHR-UHFFFAOYSA-N
XLogP2.04
TPSA83.03 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.31
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-[1-(cyanomethyl)pyrazol-4-yl]-2-methoxybenzamide
CID 167809005
2-(4-naphthalen-2-ylpyrazol-1-yl)pyridine
CID 10355830
2-methoxy-3-methyl-5-(1-pyridin-2-ylpyrazol-4-yl)pyridine
CID 154848621
2-[4-(2-fluoro-3-methoxyphenyl)pyrazol-1-yl]pyridine
CID 167984117
1-pyridin-2-ylpyrazole-4-carbonyl chloride
CID 83814309
N-[3-chloro-4-(pyridin-2-ylmethoxy)phenyl]-2-methoxy-4-(1-methylpyrazol-4-yl)benzamide
CID 135143386
1-[2-methoxy-4-(1-methylpyrazol-4-yl)phenyl]-2-pyridin-3-ylethanone
CID 157130590
2-methoxy-6-(4-pyridin-2-ylpyrazol-1-yl)pyridine
CID 10286006
2-ethoxy-4-pyridin-3-ylbenzamide
CID 155568101
N-(2-methoxy-5-methylphenyl)-1-pyridin-2-ylpyrazole-4-sulfonamide
CID 71688116
4-(3-carbamoyl-4-chlorophenyl)-2-methoxybenzoic acid
CID 53228064
ethyl 1-(4-phenyl-2-pyridinyl)pyrazole-4-carboxylate
CID 46210366

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-4-(1-pyridin-2-ylpyrazol-4-yl)benzamide?
The IUPAC name of 2-methoxy-4-(1-pyridin-2-ylpyrazol-4-yl)benzamide (CID 167872524) is 2-methoxy-4-(1-pyridin-2-ylpyrazol-4-yl)benzamide.
What is the SMILES notation for 2-methoxy-4-(1-pyridin-2-ylpyrazol-4-yl)benzamide?
The canonical SMILES for 2-methoxy-4-(1-pyridin-2-ylpyrazol-4-yl)benzamide is COc1cc(-c2cnn(-c3ccccn3)c2)ccc1C(N)=O.
What is the InChIKey of 2-methoxy-4-(1-pyridin-2-ylpyrazol-4-yl)benzamide?
The InChIKey is XCMLCPGQNZLYHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N4O2/c1-22-14-8-11(5-6-13(14)16(17)21)12-9-19-20(10-12)15-4-2-3-7-18-15/h2-10H,1H3,(H2,17,21).
What are the key properties of 2-methoxy-4-(1-pyridin-2-ylpyrazol-4-yl)benzamide?
2-methoxy-4-(1-pyridin-2-ylpyrazol-4-yl)benzamide has a molecular weight of 294.31 g/mol, XLogP of 2.04, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-4-(1-pyridin-2-ylpyrazol-4-yl)benzamide is sourced from PubChem (CID 167872524), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).