N-(2,5-dimethylpyrazol-3-yl)-2-(5-fluoro-2-oxo-1-pyridinyl)acetamide

C12H13FN4O2 — CID 99831506

IUPACN-(2,5-dimethylpyrazol-3-yl)-2-(5-fluoro-2-oxo-1-pyridinyl)acetamide
SMILESCc1cc(NC(=O)Cn2cc(F)ccc2=O)n(C)n1
InChIInChI=1S/C12H13FN4O2/c1-8-5-10(16(2)15-8)14-11(18)7-17-6-9(13)3-4-12(17)19/h3-6H,7H2,1-2H3,(H,14,18)
InChIKeyQZPLCQOSYRAOTO-UHFFFAOYSA-N
MW264.26 g/mol
LogP0.67
Rot. Bonds3

About N-(2,5-dimethylpyrazol-3-yl)-2-(5-fluoro-2-oxo-1-pyridinyl)acetamide

N-(2,5-dimethylpyrazol-3-yl)-2-(5-fluoro-2-oxo-1-pyridinyl)acetamide (PubChem CID 99831506) has the molecular formula C12H13FN4O2 and a molecular weight of 264.26 g/mol. Its IUPAC name is N-(2,5-dimethylpyrazol-3-yl)-2-(5-fluoro-2-oxo-1-pyridinyl)acetamide.

Molecular Properties

Compound NameN-(2,5-dimethylpyrazol-3-yl)-2-(5-fluoro-2-oxo-1-pyridinyl)acetamide
PubChem CID99831506
Molecular FormulaC12H13FN4O2
Molecular Weight264.26 g/mol
Exact Mass264.10
IUPAC NameN-(2,5-dimethylpyrazol-3-yl)-2-(5-fluoro-2-oxo-1-pyridinyl)acetamide
SMILESCc1cc(NC(=O)Cn2cc(F)ccc2=O)n(C)n1
InChIInChI=1S/C12H13FN4O2/c1-8-5-10(16(2)15-8)14-11(18)7-17-6-9(13)3-4-12(17)19/h3-6H,7H2,1-2H3,(H,14,18)
InChIKeyQZPLCQOSYRAOTO-UHFFFAOYSA-N
XLogP0.67
TPSA68.92 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.26
LogP ≤ 50.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(2,5-dimethylpyrazol-3-yl)-2-(5-fluoro-2-oxo-1-pyridinyl)acetamide?
The IUPAC name of N-(2,5-dimethylpyrazol-3-yl)-2-(5-fluoro-2-oxo-1-pyridinyl)acetamide (CID 99831506) is N-(2,5-dimethylpyrazol-3-yl)-2-(5-fluoro-2-oxo-1-pyridinyl)acetamide.
What is the SMILES notation for N-(2,5-dimethylpyrazol-3-yl)-2-(5-fluoro-2-oxo-1-pyridinyl)acetamide?
The canonical SMILES for N-(2,5-dimethylpyrazol-3-yl)-2-(5-fluoro-2-oxo-1-pyridinyl)acetamide is Cc1cc(NC(=O)Cn2cc(F)ccc2=O)n(C)n1.
What is the InChIKey of N-(2,5-dimethylpyrazol-3-yl)-2-(5-fluoro-2-oxo-1-pyridinyl)acetamide?
The InChIKey is QZPLCQOSYRAOTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13FN4O2/c1-8-5-10(16(2)15-8)14-11(18)7-17-6-9(13)3-4-12(17)19/h3-6H,7H2,1-2H3,(H,14,18).
What are the key properties of N-(2,5-dimethylpyrazol-3-yl)-2-(5-fluoro-2-oxo-1-pyridinyl)acetamide?
N-(2,5-dimethylpyrazol-3-yl)-2-(5-fluoro-2-oxo-1-pyridinyl)acetamide has a molecular weight of 264.26 g/mol, XLogP of 0.67, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-dimethylpyrazol-3-yl)-2-(5-fluoro-2-oxo-1-pyridinyl)acetamide is sourced from PubChem (CID 99831506), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).