N-(4-ethyl-1H-pyrazol-5-yl)-2-fluoropyridine-3-carboxamide

C11H11FN4O — CID 114037892

IUPACN-(4-ethyl-1H-pyrazol-5-yl)-2-fluoropyridine-3-carboxamide
SMILESCCc1cn[nH]c1NC(=O)c1cccnc1F
InChIInChI=1S/C11H11FN4O/c1-2-7-6-14-16-10(7)15-11(17)8-4-3-5-13-9(8)12/h3-6H,2H2,1H3,(H2,14,15,16,17)
InChIKeyIOKFZNZSDUFTQD-UHFFFAOYSA-N
MW234.23 g/mol
LogP1.76
Rot. Bonds3

About N-(4-ethyl-1H-pyrazol-5-yl)-2-fluoropyridine-3-carboxamide

N-(4-ethyl-1H-pyrazol-5-yl)-2-fluoropyridine-3-carboxamide (PubChem CID 114037892) has the molecular formula C11H11FN4O and a molecular weight of 234.23 g/mol. Its IUPAC name is N-(4-ethyl-1H-pyrazol-5-yl)-2-fluoropyridine-3-carboxamide.

Molecular Properties

Compound NameN-(4-ethyl-1H-pyrazol-5-yl)-2-fluoropyridine-3-carboxamide
PubChem CID114037892
Molecular FormulaC11H11FN4O
Molecular Weight234.23 g/mol
Exact Mass234.09
IUPAC NameN-(4-ethyl-1H-pyrazol-5-yl)-2-fluoropyridine-3-carboxamide
SMILESCCc1cn[nH]c1NC(=O)c1cccnc1F
InChIInChI=1S/C11H11FN4O/c1-2-7-6-14-16-10(7)15-11(17)8-4-3-5-13-9(8)12/h3-6H,2H2,1H3,(H2,14,15,16,17)
InChIKeyIOKFZNZSDUFTQD-UHFFFAOYSA-N
XLogP1.76
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.23
LogP ≤ 51.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

N-(4-ethyl-1H-pyrazol-5-yl)-3-hydroxypyridine-2-carboxamide
CID 104620340
3-amino-2-ethoxy-N-(4-ethyl-1H-pyrazol-5-yl)benzamide
CID 104616592
2-(difluoromethoxy)-N-(4-ethyl-1H-pyrazol-5-yl)benzamide
CID 104620278
3-amino-N-(4-ethyl-1H-pyrazol-5-yl)-2-methoxybenzamide
CID 104616630
N-(4-ethyl-1H-pyrazol-5-yl)-3,4-difluorobenzamide
CID 113251945
2-methyl-N-(4-methyl-1H-pyrazol-5-yl)pyridine-3-carboxamide
CID 115629960
5-amino-N-(4-ethyl-1H-pyrazol-5-yl)-2-methoxybenzamide
CID 104616600
2-bromo-N-(4-ethyl-1H-pyrazol-5-yl)pyridine-4-carboxamide
CID 113258806
N-(4-ethyl-1H-pyrazol-5-yl)-2-hydroxy-5-iodobenzamide
CID 103524810
N-(4-ethyl-1H-pyrazol-5-yl)-2-methoxy-3-nitrobenzamide
CID 104620300
2-fluoro-N-(6-fluoro-3-pyridinyl)pyridine-3-carboxamide
CID 107358891
N-(4-ethyl-1H-pyrazol-5-yl)-1,5-dimethylpyrazole-4-carboxamide
CID 112697383

Frequently Asked Questions

What is the IUPAC name of N-(4-ethyl-1H-pyrazol-5-yl)-2-fluoropyridine-3-carboxamide?
The IUPAC name of N-(4-ethyl-1H-pyrazol-5-yl)-2-fluoropyridine-3-carboxamide (CID 114037892) is N-(4-ethyl-1H-pyrazol-5-yl)-2-fluoropyridine-3-carboxamide.
What is the SMILES notation for N-(4-ethyl-1H-pyrazol-5-yl)-2-fluoropyridine-3-carboxamide?
The canonical SMILES for N-(4-ethyl-1H-pyrazol-5-yl)-2-fluoropyridine-3-carboxamide is CCc1cn[nH]c1NC(=O)c1cccnc1F.
What is the InChIKey of N-(4-ethyl-1H-pyrazol-5-yl)-2-fluoropyridine-3-carboxamide?
The InChIKey is IOKFZNZSDUFTQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11FN4O/c1-2-7-6-14-16-10(7)15-11(17)8-4-3-5-13-9(8)12/h3-6H,2H2,1H3,(H2,14,15,16,17).
What are the key properties of N-(4-ethyl-1H-pyrazol-5-yl)-2-fluoropyridine-3-carboxamide?
N-(4-ethyl-1H-pyrazol-5-yl)-2-fluoropyridine-3-carboxamide has a molecular weight of 234.23 g/mol, XLogP of 1.76, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-ethyl-1H-pyrazol-5-yl)-2-fluoropyridine-3-carboxamide is sourced from PubChem (CID 114037892), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).