N-[1-(4-methoxyphenyl)pyrazol-4-yl]-2-(3-pyridin-2-ylpyrazol-1-yl)acetamide

C20H18N6O2 — CID 141484726

IUPACN-[1-(4-methoxyphenyl)pyrazol-4-yl]-2-(3-pyridin-2-ylpyrazol-1-yl)acetamide
SMILESCOc1ccc(-n2cc(NC(=O)Cn3ccc(-c4ccccn4)n3)cn2)cc1
InChIInChI=1S/C20H18N6O2/c1-28-17-7-5-16(6-8-17)26-13-15(12-22-26)23-20(27)14-25-11-9-19(24-25)18-4-2-3-10-21-18/h2-13H,14H2,1H3,(H,23,27)
InChIKeyNVRYIJBQUYJOQB-UHFFFAOYSA-N
MW374.40 g/mol
LogP2.78
Rot. Bonds6

About N-[1-(4-methoxyphenyl)pyrazol-4-yl]-2-(3-pyridin-2-ylpyrazol-1-yl)acetamide

N-[1-(4-methoxyphenyl)pyrazol-4-yl]-2-(3-pyridin-2-ylpyrazol-1-yl)acetamide (PubChem CID 141484726) has the molecular formula C20H18N6O2 and a molecular weight of 374.40 g/mol. Its IUPAC name is N-[1-(4-methoxyphenyl)pyrazol-4-yl]-2-(3-pyridin-2-ylpyrazol-1-yl)acetamide.

Molecular Properties

Compound NameN-[1-(4-methoxyphenyl)pyrazol-4-yl]-2-(3-pyridin-2-ylpyrazol-1-yl)acetamide
PubChem CID141484726
Molecular FormulaC20H18N6O2
Molecular Weight374.40 g/mol
Exact Mass374.15
IUPAC NameN-[1-(4-methoxyphenyl)pyrazol-4-yl]-2-(3-pyridin-2-ylpyrazol-1-yl)acetamide
SMILESCOc1ccc(-n2cc(NC(=O)Cn3ccc(-c4ccccn4)n3)cn2)cc1
InChIInChI=1S/C20H18N6O2/c1-28-17-7-5-16(6-8-17)26-13-15(12-22-26)23-20(27)14-25-11-9-19(24-25)18-4-2-3-10-21-18/h2-13H,14H2,1H3,(H,23,27)
InChIKeyNVRYIJBQUYJOQB-UHFFFAOYSA-N
XLogP2.78
TPSA86.86 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.40
LogP ≤ 52.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

1-methyl-4-(pyridin-4-ylmethylamino)-N-(4-(trifluoromethoxy)phenyl)-1H-pyrazole-5-carboxamide
CID 44439466
N-(4-methoxyphenyl)pyrazolo[1,5-a]pyridine-2-carboxamide
CID 5308364
N-[1-(3-methoxyphenyl)pyrazol-4-yl]-2-(3-pyridin-2-ylpyrazol-1-yl)acetamide
CID 141484716
2-[3-(3-chlorophenyl)pyrazol-1-yl]-N-[1-(4-methoxyphenyl)pyrazol-4-yl]acetamide
CID 141484718
2-indol-1-yl-N-[1-(3-methoxyphenyl)pyrazol-4-yl]acetamide
CID 141484720
2-(4-methoxy-N-(1,3,5-trimethylpyrazol-4-yl)sulfonylanilino)-N-(pyridin-3-ylmethyl)acetamide
CID 5309373
N-(4-methoxyphenyl)-1-[3-(1H-pyrazol-1-yl)propanoyl]-3-piperidinamine
CID 24816914
2-indol-1-yl-N-[1-(4-methoxyphenyl)pyrazol-4-yl]acetamide
CID 141484729
N-(4-methoxyphenyl)-2-[2-(1-methylpyrrol-2-yl)-5-oxo-6,7-dihydropyrazolo[1,5-a]pyrimidin-4-yl]acetamide
CID 16028795
(E)-3-[1-benzyl-3-(3-pyridyl)pyrazol-4-yl]-N-[2-keto-2-(p-anisidino)ethyl]-N-methyl-acrylamide
CID 24980448
N-(4-phenoxyphenyl)-1-(2-(pyridin-4-yl)ethyl)-1H-pyrazole-5-carboxamide
CID 44431905
CID 132491825
CID 132491825

Frequently Asked Questions

What is the IUPAC name of N-[1-(4-methoxyphenyl)pyrazol-4-yl]-2-(3-pyridin-2-ylpyrazol-1-yl)acetamide?
The IUPAC name of N-[1-(4-methoxyphenyl)pyrazol-4-yl]-2-(3-pyridin-2-ylpyrazol-1-yl)acetamide (CID 141484726) is N-[1-(4-methoxyphenyl)pyrazol-4-yl]-2-(3-pyridin-2-ylpyrazol-1-yl)acetamide.
What is the SMILES notation for N-[1-(4-methoxyphenyl)pyrazol-4-yl]-2-(3-pyridin-2-ylpyrazol-1-yl)acetamide?
The canonical SMILES for N-[1-(4-methoxyphenyl)pyrazol-4-yl]-2-(3-pyridin-2-ylpyrazol-1-yl)acetamide is COc1ccc(-n2cc(NC(=O)Cn3ccc(-c4ccccn4)n3)cn2)cc1.
What is the InChIKey of N-[1-(4-methoxyphenyl)pyrazol-4-yl]-2-(3-pyridin-2-ylpyrazol-1-yl)acetamide?
The InChIKey is NVRYIJBQUYJOQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18N6O2/c1-28-17-7-5-16(6-8-17)26-13-15(12-22-26)23-20(27)14-25-11-9-19(24-25)18-4-2-3-10-21-18/h2-13H,14H2,1H3,(H,23,27).
What are the key properties of N-[1-(4-methoxyphenyl)pyrazol-4-yl]-2-(3-pyridin-2-ylpyrazol-1-yl)acetamide?
N-[1-(4-methoxyphenyl)pyrazol-4-yl]-2-(3-pyridin-2-ylpyrazol-1-yl)acetamide has a molecular weight of 374.40 g/mol, XLogP of 2.78, 6 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-methoxyphenyl)pyrazol-4-yl]-2-(3-pyridin-2-ylpyrazol-1-yl)acetamide is sourced from PubChem (CID 141484726), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).