N-[(5-cyclopentyl-1,2,4-oxadiazol-3-yl)methyl]-N-methyl-4H,5H,6H,7H-pyrazolo[1,5-a]pyridine-3-carboxamide

• ChemBase ID: 828594
• Molecular Formular: C17H23N5O2
• Molecular Mass: 329.39682
• Monoisotopic Mass: 329.185175
• SMILES: c1(C(=O)N(Cc2nc(on2)C2CCCC2)C)c2n(nc1)CCCC2
• Canonical SMILES: CN(C(=O)c1cnn2c1CCCC2)Cc1noc(n1)C1CCCC1
• InChI: InChI=1S/C17H23N5O2/c1-21(11-15-19-16(24-20-15)12-6-2-3-7-12)17(23)13-10-18-22-9-5-4-8-14(13)22/h10,12H,2-9,11H2,1H3
• InChIKey: IKKOBSASVUIPFX-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: N-[(5-cyclopentyl-1,2,4-oxadiazol-3-yl)methyl]-N-methyl-4H,5H,6H,7H-pyrazolo[1,5-a]pyridine-3-carboxamide
• IUPAC Traditional name: N-[(5-cyclopentyl-1,2,4-oxadiazol-3-yl)methyl]-N-methyl-4H,5H,6H,7H-pyrazolo[1,5-a]pyridine-3-carboxamide
• Synonyms: N-[(5-cyclopentyl-1,2,4-oxadiazol-3-yl)methyl]-N-methyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-3-carboxamide

CALCULATED PROPERTIES

JChem

• H Acceptors: 4
• H Donor: 0
• LogD (pH = 5.5): 1.9471276
• LogD (pH = 7.4): 1.947165
• Log P: 1.9471655
• Molar Refractivity: 102.1576 cm^3
• Polarizability: 33.302013 Å^3
• Polar Surface Area: 77.05 Å^2
• Rotatable Bonds: 4
• Lipinski's Rule of Five: true

供应商提供(Chembridge)

• H Acceptors: 5
• H Donor: 0
• Log P: 1.05
• LOG S: -2.5
• Polar Surface Area: 77.05 Å^2
• Rotatable Bonds: 4