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

C19H16N6O — CID 167793596

IUPAC4-(pyrazol-1-ylmethyl)-N-(5-pyridin-2-yl-1H-pyrazol-4-yl)benzamide
SMILESO=C(Nc1cn[nH]c1-c1ccccn1)c1ccc(Cn2cccn2)cc1
InChIInChI=1S/C19H16N6O/c26-19(15-7-5-14(6-8-15)13-25-11-3-10-22-25)23-17-12-21-24-18(17)16-4-1-2-9-20-16/h1-12H,13H2,(H,21,24)(H,23,26)
InChIKeyLVEBZFFVPXFXQX-UHFFFAOYSA-N
MW344.38 g/mol
LogP2.97
Rot. Bonds5

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

4-(pyrazol-1-ylmethyl)-N-(5-pyridin-2-yl-1H-pyrazol-4-yl)benzamide (PubChem CID 167793596) has the molecular formula C19H16N6O and a molecular weight of 344.38 g/mol. Its IUPAC name is 4-(pyrazol-1-ylmethyl)-N-(5-pyridin-2-yl-1H-pyrazol-4-yl)benzamide.

Molecular Properties

Compound Name4-(pyrazol-1-ylmethyl)-N-(5-pyridin-2-yl-1H-pyrazol-4-yl)benzamide
PubChem CID167793596
Molecular FormulaC19H16N6O
Molecular Weight344.38 g/mol
Exact Mass344.14
IUPAC Name4-(pyrazol-1-ylmethyl)-N-(5-pyridin-2-yl-1H-pyrazol-4-yl)benzamide
SMILESO=C(Nc1cn[nH]c1-c1ccccn1)c1ccc(Cn2cccn2)cc1
InChIInChI=1S/C19H16N6O/c26-19(15-7-5-14(6-8-15)13-25-11-3-10-22-25)23-17-12-21-24-18(17)16-4-1-2-9-20-16/h1-12H,13H2,(H,21,24)(H,23,26)
InChIKeyLVEBZFFVPXFXQX-UHFFFAOYSA-N
XLogP2.97
TPSA88.49 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.38
LogP ≤ 52.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

6-(ethylamino)-N-(5-pyridin-2-yl-1H-pyrazol-4-yl)pyridine-3-carboxamide
CID 166397794
5-ethyl-N-(5-pyridin-2-yl-1H-pyrazol-4-yl)pyridine-3-carboxamide
CID 166234581
N-(5-pyridin-2-yl-1H-pyrazol-4-yl)-1,3-oxazole-4-carboxamide
CID 154858973
N-(4-ethyl-3-pyridin-2-ylphenyl)-4-(pyrazol-1-ylmethyl)benzamide
CID 170124282
2-tert-butyl-N-(5-pyridin-2-yl-1H-pyrazol-4-yl)pyrimidine-5-carboxamide
CID 166225176
N-(2-methylsulfonylphenyl)-4-(pyrazol-1-ylmethyl)benzamide
CID 55534682
N-[6-[(5-pyridin-2-yl-1H-pyrazol-4-yl)amino]-3-pyridinyl]benzamide
CID 59376314
4-(pyrazol-1-ylmethyl)-N-(pyridin-2-ylmethyl)benzamide
CID 18136251
N-[2-(3-phenyl-1H-1,2,4-triazol-5-yl)phenyl]-4-(pyrazol-1-ylmethyl)benzamide
CID 55991421
1-(2-propylpyrazol-3-yl)-3-(5-pyridin-2-yl-1H-pyrazol-4-yl)urea
CID 71913780
N-(5-pyridin-2-yl-1H-pyrazol-4-yl)-3-(2,2,2-trifluoroethoxy)benzamide
CID 146081206
2-pyridin-3-yl-N-(5-pyridin-2-yl-1H-pyrazol-4-yl)acetamide
CID 166192558

Frequently Asked Questions

What is the IUPAC name of 4-(pyrazol-1-ylmethyl)-N-(5-pyridin-2-yl-1H-pyrazol-4-yl)benzamide?
The IUPAC name of 4-(pyrazol-1-ylmethyl)-N-(5-pyridin-2-yl-1H-pyrazol-4-yl)benzamide (CID 167793596) is 4-(pyrazol-1-ylmethyl)-N-(5-pyridin-2-yl-1H-pyrazol-4-yl)benzamide.
What is the SMILES notation for 4-(pyrazol-1-ylmethyl)-N-(5-pyridin-2-yl-1H-pyrazol-4-yl)benzamide?
The canonical SMILES for 4-(pyrazol-1-ylmethyl)-N-(5-pyridin-2-yl-1H-pyrazol-4-yl)benzamide is O=C(Nc1cn[nH]c1-c1ccccn1)c1ccc(Cn2cccn2)cc1.
What is the InChIKey of 4-(pyrazol-1-ylmethyl)-N-(5-pyridin-2-yl-1H-pyrazol-4-yl)benzamide?
The InChIKey is LVEBZFFVPXFXQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16N6O/c26-19(15-7-5-14(6-8-15)13-25-11-3-10-22-25)23-17-12-21-24-18(17)16-4-1-2-9-20-16/h1-12H,13H2,(H,21,24)(H,23,26).
What are the key properties of 4-(pyrazol-1-ylmethyl)-N-(5-pyridin-2-yl-1H-pyrazol-4-yl)benzamide?
4-(pyrazol-1-ylmethyl)-N-(5-pyridin-2-yl-1H-pyrazol-4-yl)benzamide has a molecular weight of 344.38 g/mol, XLogP of 2.97, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(pyrazol-1-ylmethyl)-N-(5-pyridin-2-yl-1H-pyrazol-4-yl)benzamide is sourced from PubChem (CID 167793596), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).