4-methoxy-N-(4-methyl-2-pyridinyl)-1-phenylpyrazole-3-carboxamide

C17H16N4O2 — CID 35029722

IUPAC4-methoxy-N-(4-methyl-2-pyridinyl)-1-phenylpyrazole-3-carboxamide
SMILESCOc1cn(-c2ccccc2)nc1C(=O)Nc1cc(C)ccn1
InChIInChI=1S/C17H16N4O2/c1-12-8-9-18-15(10-12)19-17(22)16-14(23-2)11-21(20-16)13-6-4-3-5-7-13/h3-11H,1-2H3,(H,18,19,22)
InChIKeyOXJMIUBHUNRWDK-UHFFFAOYSA-N
MW308.34 g/mol
LogP2.84
Rot. Bonds4

About 4-methoxy-N-(4-methyl-2-pyridinyl)-1-phenylpyrazole-3-carboxamide

4-methoxy-N-(4-methyl-2-pyridinyl)-1-phenylpyrazole-3-carboxamide (PubChem CID 35029722) has the molecular formula C17H16N4O2 and a molecular weight of 308.34 g/mol. Its IUPAC name is 4-methoxy-N-(4-methyl-2-pyridinyl)-1-phenylpyrazole-3-carboxamide.

Molecular Properties

Compound Name4-methoxy-N-(4-methyl-2-pyridinyl)-1-phenylpyrazole-3-carboxamide
PubChem CID35029722
Molecular FormulaC17H16N4O2
Molecular Weight308.34 g/mol
Exact Mass308.13
IUPAC Name4-methoxy-N-(4-methyl-2-pyridinyl)-1-phenylpyrazole-3-carboxamide
SMILESCOc1cn(-c2ccccc2)nc1C(=O)Nc1cc(C)ccn1
InChIInChI=1S/C17H16N4O2/c1-12-8-9-18-15(10-12)19-17(22)16-14(23-2)11-21(20-16)13-6-4-3-5-7-13/h3-11H,1-2H3,(H,18,19,22)
InChIKeyOXJMIUBHUNRWDK-UHFFFAOYSA-N
XLogP2.84
TPSA69.04 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.34
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-methoxy-1-phenyl-N-pyridin-2-ylpyrazole-3-carboxamide
CID 24538158
4-methoxy-N-(5-methyl-1H-pyrazol-3-yl)-1-phenylpyrazole-3-carboxamide
CID 47038566
3-(3,4-dimethoxyphenyl)-N-(4-methyl-2-pyridinyl)-1-phenylpyrazole-4-carboxamide
CID 43016709
N-(2-fluoro-5-methylphenyl)-4-methoxy-1-phenylpyrazole-3-carboxamide
CID 16561066
N-(2-bromo-4-methylphenyl)-4-methoxy-1-phenylpyrazole-3-carboxamide
CID 27844853
N-(3,4-dimethylphenyl)-4-methoxy-1-phenylpyrazole-3-carboxamide
CID 7992464
4-methoxy-1-phenyl-N-pyridin-4-ylpyrazole-3-carboxamide
CID 17440224
4-methoxy-N-[3-oxo-3-(pyridin-2-ylamino)propyl]-1-phenylpyrazole-3-carboxamide
CID 47034464
4-methoxy-1-phenyl-N-(2-phenylphenyl)pyrazole-3-carboxamide
CID 27844736
4-methoxy-N-(4-methyl-1-phenylpyrazol-5-yl)-1-phenylpyrazole-3-carboxamide
CID 167751714
4-methoxy-1-phenyl-N-quinolin-5-ylpyrazole-3-carboxamide
CID 39964657
[(2R)-1-(3-methylanilino)-1-oxopropan-2-yl] 4-methoxy-1-phenylpyrazole-3-carboxylate
CID 8703470

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N-(4-methyl-2-pyridinyl)-1-phenylpyrazole-3-carboxamide?
The IUPAC name of 4-methoxy-N-(4-methyl-2-pyridinyl)-1-phenylpyrazole-3-carboxamide (CID 35029722) is 4-methoxy-N-(4-methyl-2-pyridinyl)-1-phenylpyrazole-3-carboxamide.
What is the SMILES notation for 4-methoxy-N-(4-methyl-2-pyridinyl)-1-phenylpyrazole-3-carboxamide?
The canonical SMILES for 4-methoxy-N-(4-methyl-2-pyridinyl)-1-phenylpyrazole-3-carboxamide is COc1cn(-c2ccccc2)nc1C(=O)Nc1cc(C)ccn1.
What is the InChIKey of 4-methoxy-N-(4-methyl-2-pyridinyl)-1-phenylpyrazole-3-carboxamide?
The InChIKey is OXJMIUBHUNRWDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N4O2/c1-12-8-9-18-15(10-12)19-17(22)16-14(23-2)11-21(20-16)13-6-4-3-5-7-13/h3-11H,1-2H3,(H,18,19,22).
What are the key properties of 4-methoxy-N-(4-methyl-2-pyridinyl)-1-phenylpyrazole-3-carboxamide?
4-methoxy-N-(4-methyl-2-pyridinyl)-1-phenylpyrazole-3-carboxamide has a molecular weight of 308.34 g/mol, XLogP of 2.84, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N-(4-methyl-2-pyridinyl)-1-phenylpyrazole-3-carboxamide is sourced from PubChem (CID 35029722), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).