N-(6-fluoro-3-pyridinyl)-5-methyl-1H-pyrazole-4-carboxamide

C10H9FN4O — CID 103789931

IUPACN-(6-fluoro-3-pyridinyl)-5-methyl-1H-pyrazole-4-carboxamide
SMILESCc1[nH]ncc1C(=O)Nc1ccc(F)nc1
InChIInChI=1S/C10H9FN4O/c1-6-8(5-13-15-6)10(16)14-7-2-3-9(11)12-4-7/h2-5H,1H3,(H,13,15)(H,14,16)
InChIKeyXREHCVRAYIVTMX-UHFFFAOYSA-N
MW220.21 g/mol
LogP1.50
Rot. Bonds2

About N-(6-fluoro-3-pyridinyl)-5-methyl-1H-pyrazole-4-carboxamide

N-(6-fluoro-3-pyridinyl)-5-methyl-1H-pyrazole-4-carboxamide (PubChem CID 103789931) has the molecular formula C10H9FN4O and a molecular weight of 220.21 g/mol. Its IUPAC name is N-(6-fluoro-3-pyridinyl)-5-methyl-1H-pyrazole-4-carboxamide.

Molecular Properties

Compound NameN-(6-fluoro-3-pyridinyl)-5-methyl-1H-pyrazole-4-carboxamide
PubChem CID103789931
Molecular FormulaC10H9FN4O
Molecular Weight220.21 g/mol
Exact Mass220.08
IUPAC NameN-(6-fluoro-3-pyridinyl)-5-methyl-1H-pyrazole-4-carboxamide
SMILESCc1[nH]ncc1C(=O)Nc1ccc(F)nc1
InChIInChI=1S/C10H9FN4O/c1-6-8(5-13-15-6)10(16)14-7-2-3-9(11)12-4-7/h2-5H,1H3,(H,13,15)(H,14,16)
InChIKeyXREHCVRAYIVTMX-UHFFFAOYSA-N
XLogP1.50
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.21
LogP ≤ 51.50
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-fluorophenyl)-5-methyl-1H-pyrazole-4-carboxamide
CID 60757361
N-(3,4-difluorophenyl)-5-methyl-1H-pyrazole-4-carboxamide
CID 60757426
N-(6-fluoro-3-pyridinyl)-4-methylthiophene-3-carboxamide
CID 103789592
N-(3-iodo-4-methylphenyl)-5-methyl-1H-pyrazole-4-carboxamide
CID 63997812
3-chloro-N-(6-fluoro-3-pyridinyl)-2-methylbenzamide
CID 107143571
N-(6-fluoro-3-pyridinyl)-1,3-dimethylpyrazole-4-carboxamide
CID 103789989
N-(4-ethylsulfonylphenyl)-5-methyl-1H-pyrazole-4-carboxamide
CID 63998428
N-(2-bromo-5-fluorophenyl)-5-methyl-1H-pyrazole-4-carboxamide
CID 103754876
2-fluoro-N-(6-fluoro-3-pyridinyl)pyridine-3-carboxamide
CID 107358891
N-(6-fluoro-3-pyridinyl)-2-iodobenzamide
CID 103789921
5-methyl-N-[4-[(propan-2-ylamino)methyl]phenyl]-1H-pyrazole-4-carboxamide
CID 106910470
N-(2-acetylphenyl)-5-methyl-1H-pyrazole-4-carboxamide
CID 63998634

Frequently Asked Questions

What is the IUPAC name of N-(6-fluoro-3-pyridinyl)-5-methyl-1H-pyrazole-4-carboxamide?
The IUPAC name of N-(6-fluoro-3-pyridinyl)-5-methyl-1H-pyrazole-4-carboxamide (CID 103789931) is N-(6-fluoro-3-pyridinyl)-5-methyl-1H-pyrazole-4-carboxamide.
What is the SMILES notation for N-(6-fluoro-3-pyridinyl)-5-methyl-1H-pyrazole-4-carboxamide?
The canonical SMILES for N-(6-fluoro-3-pyridinyl)-5-methyl-1H-pyrazole-4-carboxamide is Cc1[nH]ncc1C(=O)Nc1ccc(F)nc1.
What is the InChIKey of N-(6-fluoro-3-pyridinyl)-5-methyl-1H-pyrazole-4-carboxamide?
The InChIKey is XREHCVRAYIVTMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9FN4O/c1-6-8(5-13-15-6)10(16)14-7-2-3-9(11)12-4-7/h2-5H,1H3,(H,13,15)(H,14,16).
What are the key properties of N-(6-fluoro-3-pyridinyl)-5-methyl-1H-pyrazole-4-carboxamide?
N-(6-fluoro-3-pyridinyl)-5-methyl-1H-pyrazole-4-carboxamide has a molecular weight of 220.21 g/mol, XLogP of 1.50, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-fluoro-3-pyridinyl)-5-methyl-1H-pyrazole-4-carboxamide is sourced from PubChem (CID 103789931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).