4-methoxy-1-phenyl-N-pyridin-4-ylpyrazole-3-carboxamide

C16H14N4O2 — CID 17440224

IUPAC4-methoxy-1-phenyl-N-pyridin-4-ylpyrazole-3-carboxamide
SMILESCOc1cn(-c2ccccc2)nc1C(=O)Nc1ccncc1
InChIInChI=1S/C16H14N4O2/c1-22-14-11-20(13-5-3-2-4-6-13)19-15(14)16(21)18-12-7-9-17-10-8-12/h2-11H,1H3,(H,17,18,21)
InChIKeyKJXPKGAEOIMXCO-UHFFFAOYSA-N
MW294.31 g/mol
LogP2.53
Rot. Bonds4

About 4-methoxy-1-phenyl-N-pyridin-4-ylpyrazole-3-carboxamide

4-methoxy-1-phenyl-N-pyridin-4-ylpyrazole-3-carboxamide (PubChem CID 17440224) has the molecular formula C16H14N4O2 and a molecular weight of 294.31 g/mol. Its IUPAC name is 4-methoxy-1-phenyl-N-pyridin-4-ylpyrazole-3-carboxamide.

Molecular Properties

Compound Name4-methoxy-1-phenyl-N-pyridin-4-ylpyrazole-3-carboxamide
PubChem CID17440224
Molecular FormulaC16H14N4O2
Molecular Weight294.31 g/mol
Exact Mass294.11
IUPAC Name4-methoxy-1-phenyl-N-pyridin-4-ylpyrazole-3-carboxamide
SMILESCOc1cn(-c2ccccc2)nc1C(=O)Nc1ccncc1
InChIInChI=1S/C16H14N4O2/c1-22-14-11-20(13-5-3-2-4-6-13)19-15(14)16(21)18-12-7-9-17-10-8-12/h2-11H,1H3,(H,17,18,21)
InChIKeyKJXPKGAEOIMXCO-UHFFFAOYSA-N
XLogP2.53
TPSA69.04 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 ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(3,4-dimethylphenyl)-4-methoxy-1-phenylpyrazole-3-carboxamide
CID 7992464
4-methoxy-1-phenyl-N-pyridin-2-ylpyrazole-3-carboxamide
CID 24538158
N-(4-butan-2-ylphenyl)-4-methoxy-1-phenylpyrazole-3-carboxamide
CID 16561064
4-methoxy-1-phenyl-N-[4-(propylcarbamoyl)phenyl]pyrazole-3-carboxamide
CID 55892920
3-(2-methoxyphenyl)-1-phenyl-N-pyridin-4-ylpyrazole-4-carboxamide
CID 30157703
4-methoxy-1-phenyl-N-(2-propan-2-yloxyphenyl)pyrazole-3-carboxamide
CID 39498587
4-methoxy-1-phenyl-N-(2-phenylphenyl)pyrazole-3-carboxamide
CID 27844736
4-methoxy-N-(4-methyl-2-pyridinyl)-1-phenylpyrazole-3-carboxamide
CID 35029722
4-methoxy-N-[4-(1-methoxypropan-2-ylsulfamoyl)phenyl]-1-phenylpyrazole-3-carboxamide
CID 55381026
N-(2,3-difluorophenyl)-4-methoxy-1-phenylpyrazole-3-carboxamide
CID 51095266
N'-(4-methoxy-1-phenylpyrazole-3-carbonyl)pyridine-3-carbohydrazide
CID 26721272
N-(1-acetyl-2,3-dihydroindol-5-yl)-4-methoxy-1-phenylpyrazole-3-carboxamide
CID 39964656

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-1-phenyl-N-pyridin-4-ylpyrazole-3-carboxamide?
The IUPAC name of 4-methoxy-1-phenyl-N-pyridin-4-ylpyrazole-3-carboxamide (CID 17440224) is 4-methoxy-1-phenyl-N-pyridin-4-ylpyrazole-3-carboxamide.
What is the SMILES notation for 4-methoxy-1-phenyl-N-pyridin-4-ylpyrazole-3-carboxamide?
The canonical SMILES for 4-methoxy-1-phenyl-N-pyridin-4-ylpyrazole-3-carboxamide is COc1cn(-c2ccccc2)nc1C(=O)Nc1ccncc1.
What is the InChIKey of 4-methoxy-1-phenyl-N-pyridin-4-ylpyrazole-3-carboxamide?
The InChIKey is KJXPKGAEOIMXCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N4O2/c1-22-14-11-20(13-5-3-2-4-6-13)19-15(14)16(21)18-12-7-9-17-10-8-12/h2-11H,1H3,(H,17,18,21).
What are the key properties of 4-methoxy-1-phenyl-N-pyridin-4-ylpyrazole-3-carboxamide?
4-methoxy-1-phenyl-N-pyridin-4-ylpyrazole-3-carboxamide has a molecular weight of 294.31 g/mol, XLogP of 2.53, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-1-phenyl-N-pyridin-4-ylpyrazole-3-carboxamide is sourced from PubChem (CID 17440224), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).