5-fluoro-3-methyl-N-[3-(1H-pyrazol-5-yl)phenyl]pyridine-2-carboxamide

C16H13FN4O — CID 146075209

IUPAC5-fluoro-3-methyl-N-[3-(1H-pyrazol-5-yl)phenyl]pyridine-2-carboxamide
SMILESCc1cc(F)cnc1C(=O)Nc1cccc(-c2ccn[nH]2)c1
InChIInChI=1S/C16H13FN4O/c1-10-7-12(17)9-18-15(10)16(22)20-13-4-2-3-11(8-13)14-5-6-19-21-14/h2-9H,1H3,(H,19,21)(H,20,22)
InChIKeyAEHKKRJHWJOBAL-UHFFFAOYSA-N
MW296.31 g/mol
LogP3.17
Rot. Bonds3

About 5-fluoro-3-methyl-N-[3-(1H-pyrazol-5-yl)phenyl]pyridine-2-carboxamide

5-fluoro-3-methyl-N-[3-(1H-pyrazol-5-yl)phenyl]pyridine-2-carboxamide (PubChem CID 146075209) has the molecular formula C16H13FN4O and a molecular weight of 296.31 g/mol. Its IUPAC name is 5-fluoro-3-methyl-N-[3-(1H-pyrazol-5-yl)phenyl]pyridine-2-carboxamide.

Molecular Properties

Compound Name5-fluoro-3-methyl-N-[3-(1H-pyrazol-5-yl)phenyl]pyridine-2-carboxamide
PubChem CID146075209
Molecular FormulaC16H13FN4O
Molecular Weight296.31 g/mol
Exact Mass296.11
IUPAC Name5-fluoro-3-methyl-N-[3-(1H-pyrazol-5-yl)phenyl]pyridine-2-carboxamide
SMILESCc1cc(F)cnc1C(=O)Nc1cccc(-c2ccn[nH]2)c1
InChIInChI=1S/C16H13FN4O/c1-10-7-12(17)9-18-15(10)16(22)20-13-4-2-3-11(8-13)14-5-6-19-21-14/h2-9H,1H3,(H,19,21)(H,20,22)
InChIKeyAEHKKRJHWJOBAL-UHFFFAOYSA-N
XLogP3.17
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.31
LogP ≤ 53.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-bromo-N-[3-(1H-pyrazol-5-yl)phenyl]pyridine-2-carboxamide
CID 107518369
2-methyl-N-[3-(1H-pyrazol-5-yl)phenyl]pyridine-4-carboxamide
CID 106753513
4-methyl-N-[3-(1H-pyrazol-5-yl)phenyl]-1,2-oxazole-5-carboxamide
CID 66335716
2-(4-fluorophenoxy)-N-[3-(1H-pyrazol-5-yl)phenyl]acetamide
CID 38808772
1-phenyl-3-[3-(1H-pyrazol-5-yl)phenyl]urea
CID 60969581
3-(4-fluoro-2-methylphenoxy)-N-[3-(1H-pyrazol-5-yl)phenyl]-6-(trifluoromethyl)pyridazine-4-carboxamide
CID 167199266
N-[3-(1H-pyrazol-5-yl)phenyl]furan-2-carboxamide
CID 37044226
2-(tert-butylamino)-N-[3-(1H-pyrazol-5-yl)phenyl]acetamide
CID 47842566
4-(carbamoylamino)-N-[3-(1H-pyrazol-5-yl)phenyl]benzamide
CID 43073751
4-fluoro-2-methyl-N-[3-(1H-pyrazol-5-yl)phenyl]benzenesulfonamide
CID 39330217
methyl 2,4-dimethyl-5-[[3-(1H-pyrazol-5-yl)phenyl]carbamoyl]-1H-pyrrole-3-carboxylate
CID 46602095
6-methyl-4-oxo-N-[3-(1H-pyrazol-5-yl)phenyl]-1-[2-(trifluoromethyl)phenyl]pyridazine-3-carboxamide
CID 46412484

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-3-methyl-N-[3-(1H-pyrazol-5-yl)phenyl]pyridine-2-carboxamide?
The IUPAC name of 5-fluoro-3-methyl-N-[3-(1H-pyrazol-5-yl)phenyl]pyridine-2-carboxamide (CID 146075209) is 5-fluoro-3-methyl-N-[3-(1H-pyrazol-5-yl)phenyl]pyridine-2-carboxamide.
What is the SMILES notation for 5-fluoro-3-methyl-N-[3-(1H-pyrazol-5-yl)phenyl]pyridine-2-carboxamide?
The canonical SMILES for 5-fluoro-3-methyl-N-[3-(1H-pyrazol-5-yl)phenyl]pyridine-2-carboxamide is Cc1cc(F)cnc1C(=O)Nc1cccc(-c2ccn[nH]2)c1.
What is the InChIKey of 5-fluoro-3-methyl-N-[3-(1H-pyrazol-5-yl)phenyl]pyridine-2-carboxamide?
The InChIKey is AEHKKRJHWJOBAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13FN4O/c1-10-7-12(17)9-18-15(10)16(22)20-13-4-2-3-11(8-13)14-5-6-19-21-14/h2-9H,1H3,(H,19,21)(H,20,22).
What are the key properties of 5-fluoro-3-methyl-N-[3-(1H-pyrazol-5-yl)phenyl]pyridine-2-carboxamide?
5-fluoro-3-methyl-N-[3-(1H-pyrazol-5-yl)phenyl]pyridine-2-carboxamide has a molecular weight of 296.31 g/mol, XLogP of 3.17, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-3-methyl-N-[3-(1H-pyrazol-5-yl)phenyl]pyridine-2-carboxamide is sourced from PubChem (CID 146075209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).