N-(1-phenylpyrazol-4-yl)-2-(3-pyridin-2-ylpyrazol-1-yl)acetamide

C19H16N6O — CID 141484735

IUPACN-(1-phenylpyrazol-4-yl)-2-(3-pyridin-2-ylpyrazol-1-yl)acetamide
SMILESO=C(Cn1ccc(-c2ccccn2)n1)Nc1cnn(-c2ccccc2)c1
InChIInChI=1S/C19H16N6O/c26-19(14-24-11-9-18(23-24)17-8-4-5-10-20-17)22-15-12-21-25(13-15)16-6-2-1-3-7-16/h1-13H,14H2,(H,22,26)
InChIKeyOHJJNICSOGMLGO-UHFFFAOYSA-N
MW344.38 g/mol
LogP2.77
Rot. Bonds5

About N-(1-phenylpyrazol-4-yl)-2-(3-pyridin-2-ylpyrazol-1-yl)acetamide

N-(1-phenylpyrazol-4-yl)-2-(3-pyridin-2-ylpyrazol-1-yl)acetamide (PubChem CID 141484735) has the molecular formula C19H16N6O and a molecular weight of 344.38 g/mol. Its IUPAC name is N-(1-phenylpyrazol-4-yl)-2-(3-pyridin-2-ylpyrazol-1-yl)acetamide.

Molecular Properties

Compound NameN-(1-phenylpyrazol-4-yl)-2-(3-pyridin-2-ylpyrazol-1-yl)acetamide
PubChem CID141484735
Molecular FormulaC19H16N6O
Molecular Weight344.38 g/mol
Exact Mass344.14
IUPAC NameN-(1-phenylpyrazol-4-yl)-2-(3-pyridin-2-ylpyrazol-1-yl)acetamide
SMILESO=C(Cn1ccc(-c2ccccn2)n1)Nc1cnn(-c2ccccc2)c1
InChIInChI=1S/C19H16N6O/c26-19(14-24-11-9-18(23-24)17-8-4-5-10-20-17)22-15-12-21-25(13-15)16-6-2-1-3-7-16/h1-13H,14H2,(H,22,26)
InChIKeyOHJJNICSOGMLGO-UHFFFAOYSA-N
XLogP2.77
TPSA77.63 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.38
LogP ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-(1-phenylpyrazol-4-yl)-2-(3-pyridin-2-ylpyrazol-1-yl)acetamide?
The IUPAC name of N-(1-phenylpyrazol-4-yl)-2-(3-pyridin-2-ylpyrazol-1-yl)acetamide (CID 141484735) is N-(1-phenylpyrazol-4-yl)-2-(3-pyridin-2-ylpyrazol-1-yl)acetamide.
What is the SMILES notation for N-(1-phenylpyrazol-4-yl)-2-(3-pyridin-2-ylpyrazol-1-yl)acetamide?
The canonical SMILES for N-(1-phenylpyrazol-4-yl)-2-(3-pyridin-2-ylpyrazol-1-yl)acetamide is O=C(Cn1ccc(-c2ccccn2)n1)Nc1cnn(-c2ccccc2)c1.
What is the InChIKey of N-(1-phenylpyrazol-4-yl)-2-(3-pyridin-2-ylpyrazol-1-yl)acetamide?
The InChIKey is OHJJNICSOGMLGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16N6O/c26-19(14-24-11-9-18(23-24)17-8-4-5-10-20-17)22-15-12-21-25(13-15)16-6-2-1-3-7-16/h1-13H,14H2,(H,22,26).
What are the key properties of N-(1-phenylpyrazol-4-yl)-2-(3-pyridin-2-ylpyrazol-1-yl)acetamide?
N-(1-phenylpyrazol-4-yl)-2-(3-pyridin-2-ylpyrazol-1-yl)acetamide has a molecular weight of 344.38 g/mol, XLogP of 2.77, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-phenylpyrazol-4-yl)-2-(3-pyridin-2-ylpyrazol-1-yl)acetamide is sourced from PubChem (CID 141484735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).