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

C15H16N6O — CID 141484717

IUPACN-(1-ethylpyrazol-4-yl)-2-(3-pyridin-2-ylpyrazol-1-yl)acetamide
SMILESCCn1cc(NC(=O)Cn2ccc(-c3ccccn3)n2)cn1
InChIInChI=1S/C15H16N6O/c1-2-20-10-12(9-17-20)18-15(22)11-21-8-6-14(19-21)13-5-3-4-7-16-13/h3-10H,2,11H2,1H3,(H,18,22)
InChIKeyFZGFUDGRUQOTPQ-UHFFFAOYSA-N
MW296.33 g/mol
LogP1.80
Rot. Bonds5

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

N-(1-ethylpyrazol-4-yl)-2-(3-pyridin-2-ylpyrazol-1-yl)acetamide (PubChem CID 141484717) has the molecular formula C15H16N6O and a molecular weight of 296.33 g/mol. Its IUPAC name is N-(1-ethylpyrazol-4-yl)-2-(3-pyridin-2-ylpyrazol-1-yl)acetamide.

Molecular Properties

Compound NameN-(1-ethylpyrazol-4-yl)-2-(3-pyridin-2-ylpyrazol-1-yl)acetamide
PubChem CID141484717
Molecular FormulaC15H16N6O
Molecular Weight296.33 g/mol
Exact Mass296.14
IUPAC NameN-(1-ethylpyrazol-4-yl)-2-(3-pyridin-2-ylpyrazol-1-yl)acetamide
SMILESCCn1cc(NC(=O)Cn2ccc(-c3ccccn3)n2)cn1
InChIInChI=1S/C15H16N6O/c1-2-20-10-12(9-17-20)18-15(22)11-21-8-6-14(19-21)13-5-3-4-7-16-13/h3-10H,2,11H2,1H3,(H,18,22)
InChIKeyFZGFUDGRUQOTPQ-UHFFFAOYSA-N
XLogP1.80
TPSA77.63 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.33
LogP ≤ 51.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-(1-ethylpyrazol-4-yl)-2-(3-pyridin-2-ylpyrazol-1-yl)acetamide?
The IUPAC name of N-(1-ethylpyrazol-4-yl)-2-(3-pyridin-2-ylpyrazol-1-yl)acetamide (CID 141484717) is N-(1-ethylpyrazol-4-yl)-2-(3-pyridin-2-ylpyrazol-1-yl)acetamide.
What is the SMILES notation for N-(1-ethylpyrazol-4-yl)-2-(3-pyridin-2-ylpyrazol-1-yl)acetamide?
The canonical SMILES for N-(1-ethylpyrazol-4-yl)-2-(3-pyridin-2-ylpyrazol-1-yl)acetamide is CCn1cc(NC(=O)Cn2ccc(-c3ccccn3)n2)cn1.
What is the InChIKey of N-(1-ethylpyrazol-4-yl)-2-(3-pyridin-2-ylpyrazol-1-yl)acetamide?
The InChIKey is FZGFUDGRUQOTPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N6O/c1-2-20-10-12(9-17-20)18-15(22)11-21-8-6-14(19-21)13-5-3-4-7-16-13/h3-10H,2,11H2,1H3,(H,18,22).
What are the key properties of N-(1-ethylpyrazol-4-yl)-2-(3-pyridin-2-ylpyrazol-1-yl)acetamide?
N-(1-ethylpyrazol-4-yl)-2-(3-pyridin-2-ylpyrazol-1-yl)acetamide has a molecular weight of 296.33 g/mol, XLogP of 1.80, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-ethylpyrazol-4-yl)-2-(3-pyridin-2-ylpyrazol-1-yl)acetamide is sourced from PubChem (CID 141484717), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).