N-(5-phenyl-2H-pyrazolo[3,4-b]pyridin-3-yl)propanamide

C15H14N4O — CID 6539534

IUPACN-(5-phenyl-2H-pyrazolo[3,4-b]pyridin-3-yl)propanamide
SMILESCCC(=O)Nc1[nH]nc2ncc(-c3ccccc3)cc12
InChIInChI=1S/C15H14N4O/c1-2-13(20)17-15-12-8-11(9-16-14(12)18-19-15)10-6-4-3-5-7-10/h3-9H,2H2,1H3,(H2,16,17,18,19,20)
InChIKeyMJZQCHSSWCBKHZ-UHFFFAOYSA-N
MW266.30 g/mol
LogP2.97
Rot. Bonds3

About N-(5-phenyl-2H-pyrazolo[3,4-b]pyridin-3-yl)propanamide

N-(5-phenyl-2H-pyrazolo[3,4-b]pyridin-3-yl)propanamide (PubChem CID 6539534) has the molecular formula C15H14N4O and a molecular weight of 266.30 g/mol. Its IUPAC name is N-(5-phenyl-2H-pyrazolo[3,4-b]pyridin-3-yl)propanamide.

Molecular Properties

Compound NameN-(5-phenyl-2H-pyrazolo[3,4-b]pyridin-3-yl)propanamide
PubChem CID6539534
Molecular FormulaC15H14N4O
Molecular Weight266.30 g/mol
Exact Mass266.12
IUPAC NameN-(5-phenyl-2H-pyrazolo[3,4-b]pyridin-3-yl)propanamide
SMILESCCC(=O)Nc1[nH]nc2ncc(-c3ccccc3)cc12
InChIInChI=1S/C15H14N4O/c1-2-13(20)17-15-12-8-11(9-16-14(12)18-19-15)10-6-4-3-5-7-10/h3-9H,2H2,1H3,(H2,16,17,18,19,20)
InChIKeyMJZQCHSSWCBKHZ-UHFFFAOYSA-N
XLogP2.97
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.30
LogP ≤ 52.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[5-(pyridin-3-yl)-1H-pyrazolo[3,4-c]pyridazin-3-yl]cyclopropanecarboxamide
CID 6539561
N-(5-Phenyl-1H-pyrazolo[3,4-c]pyridin-3-yl)butanamide
CID 6539526
5-phenyl-1H-pyrazolo[3,4-b]pyridin-3-amine
CID 6539528
Pyrazolopyridine deriv. 9
CID 6539533
N-(5-phenyl-2H-pyrazolo[3,4-b]pyridin-3-yl)butanamide
CID 6539535
N-(5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazolo[3,4-b]pyridin-3-yl)butyramide
CID 6539540
N-[5-(2-fluorophenyl)-1H-pyrazolo[3,4-b]pyridin-3-yl]butanamide
CID 6539542
N-(5-Pyridin-3-yl-1H-pyrazolo[3,4-b]pyridin-3-yl)butyramide
CID 6539546
N-{5,6-diphenyl-1H-pyrazolo[3,4-b]pyridin-3-yl}cyclopropanecarboxamide
CID 6539577
N-(6-(pyridin-4-yl)-1H-indazol-3-yl)butyramide
CID 10085059
n-[4-(3-Amino-1h-pyrazolo[3,4-b]pyridin-4-yl)phenyl]-n'-(3-methylphenyl)urea
CID 11646161
1-[4-(3-amino-2H-pyrazolo[3,4-b]pyridin-4-yl)phenyl]-3-(3,5-dimethylphenyl)urea
CID 11660744

Frequently Asked Questions

What is the IUPAC name of N-(5-phenyl-2H-pyrazolo[3,4-b]pyridin-3-yl)propanamide?
The IUPAC name of N-(5-phenyl-2H-pyrazolo[3,4-b]pyridin-3-yl)propanamide (CID 6539534) is N-(5-phenyl-2H-pyrazolo[3,4-b]pyridin-3-yl)propanamide.
What is the SMILES notation for N-(5-phenyl-2H-pyrazolo[3,4-b]pyridin-3-yl)propanamide?
The canonical SMILES for N-(5-phenyl-2H-pyrazolo[3,4-b]pyridin-3-yl)propanamide is CCC(=O)Nc1[nH]nc2ncc(-c3ccccc3)cc12.
What is the InChIKey of N-(5-phenyl-2H-pyrazolo[3,4-b]pyridin-3-yl)propanamide?
The InChIKey is MJZQCHSSWCBKHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N4O/c1-2-13(20)17-15-12-8-11(9-16-14(12)18-19-15)10-6-4-3-5-7-10/h3-9H,2H2,1H3,(H2,16,17,18,19,20).
What are the key properties of N-(5-phenyl-2H-pyrazolo[3,4-b]pyridin-3-yl)propanamide?
N-(5-phenyl-2H-pyrazolo[3,4-b]pyridin-3-yl)propanamide has a molecular weight of 266.30 g/mol, XLogP of 2.97, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-phenyl-2H-pyrazolo[3,4-b]pyridin-3-yl)propanamide is sourced from PubChem (CID 6539534), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).