N-(2-fluorophenyl)-5-methyl-1-pyridin-2-ylpyrazole-4-carboxamide

C16H13FN4O — CID 15944125

IUPACN-(2-fluorophenyl)-5-methyl-1-pyridin-2-ylpyrazole-4-carboxamide
SMILESCc1c(C(=O)Nc2ccccc2F)cnn1-c1ccccn1
InChIInChI=1S/C16H13FN4O/c1-11-12(10-19-21(11)15-8-4-5-9-18-15)16(22)20-14-7-3-2-6-13(14)17/h2-10H,1H3,(H,20,22)
InChIKeyPHSSSQUWGGWJIO-UHFFFAOYSA-N
MW296.31 g/mol
LogP2.97
Rot. Bonds3

About N-(2-fluorophenyl)-5-methyl-1-pyridin-2-ylpyrazole-4-carboxamide

N-(2-fluorophenyl)-5-methyl-1-pyridin-2-ylpyrazole-4-carboxamide (PubChem CID 15944125) has the molecular formula C16H13FN4O and a molecular weight of 296.31 g/mol. Its IUPAC name is N-(2-fluorophenyl)-5-methyl-1-pyridin-2-ylpyrazole-4-carboxamide.

Molecular Properties

Compound NameN-(2-fluorophenyl)-5-methyl-1-pyridin-2-ylpyrazole-4-carboxamide
PubChem CID15944125
Molecular FormulaC16H13FN4O
Molecular Weight296.31 g/mol
Exact Mass296.11
IUPAC NameN-(2-fluorophenyl)-5-methyl-1-pyridin-2-ylpyrazole-4-carboxamide
SMILESCc1c(C(=O)Nc2ccccc2F)cnn1-c1ccccn1
InChIInChI=1S/C16H13FN4O/c1-11-12(10-19-21(11)15-8-4-5-9-18-15)16(22)20-14-7-3-2-6-13(14)17/h2-10H,1H3,(H,20,22)
InChIKeyPHSSSQUWGGWJIO-UHFFFAOYSA-N
XLogP2.97
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.31
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2,5-difluorophenyl)-5-methyl-1-pyridin-2-ylpyrazole-4-carboxamide
CID 24825171
5-methyl-1-pyridin-2-yl-N-[2-(trifluoromethyl)phenyl]pyrazole-4-carboxamide
CID 108793336
methyl 2-[(5-methyl-1-pyridin-2-ylpyrazole-4-carbonyl)amino]benzoate
CID 15944141
5-methyl-N-(2-propoxyphenyl)-1-pyridin-2-ylpyrazole-4-carboxamide
CID 39093834
5-methyl-N-[2-(methylsulfinylmethyl)phenyl]-1-pyridin-2-ylpyrazole-4-carboxamide
CID 139004120
5-methyl-1-pyridin-2-ylpyrazole-4-carbohydrazide
CID 10998462
N-(2-aminoethyl)-5-methyl-1-pyridin-2-ylpyrazole-4-carboxamide
CID 108793385
N-tert-butyl-5-methyl-1-pyridin-2-ylpyrazole-4-carboxamide
CID 47166966
N-[1-(2-fluorophenyl)propan-2-yl]-5-methyl-1-pyridin-2-ylpyrazole-4-carboxamide
CID 86830130
N-(2-iodo-5-methoxyphenyl)-5-methyl-1-pyridin-2-ylpyrazole-4-carboxamide
CID 154806253
N-(3-tert-butyl-1-pyridin-2-ylpyrazol-5-yl)-1-(2-fluorophenyl)-5-methylpyrazole-4-carboxamide
CID 56550345
5-ethyl-N-(2-methylphenyl)-1-pyridin-2-ylpyrazole-4-carboxamide
CID 15944173

Frequently Asked Questions

What is the IUPAC name of N-(2-fluorophenyl)-5-methyl-1-pyridin-2-ylpyrazole-4-carboxamide?
The IUPAC name of N-(2-fluorophenyl)-5-methyl-1-pyridin-2-ylpyrazole-4-carboxamide (CID 15944125) is N-(2-fluorophenyl)-5-methyl-1-pyridin-2-ylpyrazole-4-carboxamide.
What is the SMILES notation for N-(2-fluorophenyl)-5-methyl-1-pyridin-2-ylpyrazole-4-carboxamide?
The canonical SMILES for N-(2-fluorophenyl)-5-methyl-1-pyridin-2-ylpyrazole-4-carboxamide is Cc1c(C(=O)Nc2ccccc2F)cnn1-c1ccccn1.
What is the InChIKey of N-(2-fluorophenyl)-5-methyl-1-pyridin-2-ylpyrazole-4-carboxamide?
The InChIKey is PHSSSQUWGGWJIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13FN4O/c1-11-12(10-19-21(11)15-8-4-5-9-18-15)16(22)20-14-7-3-2-6-13(14)17/h2-10H,1H3,(H,20,22).
What are the key properties of N-(2-fluorophenyl)-5-methyl-1-pyridin-2-ylpyrazole-4-carboxamide?
N-(2-fluorophenyl)-5-methyl-1-pyridin-2-ylpyrazole-4-carboxamide has a molecular weight of 296.31 g/mol, XLogP of 2.97, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluorophenyl)-5-methyl-1-pyridin-2-ylpyrazole-4-carboxamide is sourced from PubChem (CID 15944125), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).