N-(piperidin-4-yl)-N-(pyridin-3-ylmethyl)-4H,5H,6H,7H-pyrazolo[1,5-a]pyridine-3-carboxamide

• ChemBase ID: 721769
• Molecular Formular: C19H25N5O
• Molecular Mass: 339.4347
• Monoisotopic Mass: 339.20591045
• SMILES: c1(C(=O)N(Cc2cnccc2)C2CCNCC2)c2n(nc1)CCCC2
• Canonical SMILES: O=C(c1cnn2c1CCCC2)N(C1CCNCC1)Cc1cccnc1
• InChI: InChI=1S/C19H25N5O/c25-19(17-13-22-24-11-2-1-5-18(17)24)23(16-6-9-20-10-7-16)14-15-4-3-8-21-12-15/h3-4,8,12-13,16,20H,1-2,5-7,9-11,14H2
• InChIKey: WUNNJRFQTIZVLG-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: N-(piperidin-4-yl)-N-(pyridin-3-ylmethyl)-4H,5H,6H,7H-pyrazolo[1,5-a]pyridine-3-carboxamide
• IUPAC Traditional name: N-(piperidin-4-yl)-N-(pyridin-3-ylmethyl)-4H,5H,6H,7H-pyrazolo[1,5-a]pyridine-3-carboxamide
• Synonyms: N-piperidin-4-yl-N-(pyridin-3-ylmethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-3-carboxamide

CALCULATED PROPERTIES

JChem

• H Acceptors: 4
• H Donor: 1
• LogD (pH = 5.5): -2.749677
• LogD (pH = 7.4): -1.9934735
• Log P: 0.5427767
• Molar Refractivity: 108.9884 cm^3
• Polarizability: 36.993492 Å^3
• Polar Surface Area: 63.05 Å^2
• Rotatable Bonds: 4
• Lipinski's Rule of Five: true

供应商提供(Chembridge)

• H Acceptors: 4
• H Donor: 1
• Log P: 0.35
• LOG S: -1.98
• Polar Surface Area: 63.05 Å^2
• Rotatable Bonds: 4