2-[[3-Methyl-1-(3-pyridinylmethyl)-1H-pyrazol-5-yl]amino]benzoic acid

HCID 22320205
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Basic information

Standard SMILES
Cc1cc(Nc2ccccc2C(=O)O)n(Cc2cccnc2)n1
InChIKey
XPQRZZFHZAYGAZ-UHFFFAOYSA-N
Molecular formula
C17H16N4O2
Average molar mass
308.33 g/mol

Names & identifiers

Preferred name
2-[[3-Methyl-1-(3-pyridinylmethyl)-1H-pyrazol-5-yl]amino]benzoic acid
IUPAC
2-[[5-methyl-2-(pyridin-3-ylmethyl)pyrazol-3-yl]amino]benzoic acid

Names & synonyms

SCHEMBL6344420XPQRZZFHZAYGAZ-UHFFFAOYSA-N2-[[3-Methyl-1-(3-pyridinylmethyl)-1H-pyrazol-5-yl]amino]benzoic acid

Database identifiers

PubChem CID
22320205

Properties

Computed structural properties

XLogP
3.1
Topological polar surface area
80 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
5
Rotatable bonds
5
Heavy atoms
23

Related reactions

1 records
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Compound notes

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