N-(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)-3-pyridin-3-ylpropanamide

C16H17N5O — CID 25349353

IUPACN-(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)-3-pyridin-3-ylpropanamide
SMILESCc1nn(C)c2ncc(NC(=O)CCc3cccnc3)cc12
InChIInChI=1S/C16H17N5O/c1-11-14-8-13(10-18-16(14)21(2)20-11)19-15(22)6-5-12-4-3-7-17-9-12/h3-4,7-10H,5-6H2,1-2H3,(H,19,22)
InChIKeyCSWMKPVSBQUUBY-UHFFFAOYSA-N
MW295.35 g/mol
LogP2.24
Rot. Bonds4

About N-(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)-3-pyridin-3-ylpropanamide

N-(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)-3-pyridin-3-ylpropanamide (PubChem CID 25349353) has the molecular formula C16H17N5O and a molecular weight of 295.35 g/mol. Its IUPAC name is N-(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)-3-pyridin-3-ylpropanamide.

Molecular Properties

Compound NameN-(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)-3-pyridin-3-ylpropanamide
PubChem CID25349353
Molecular FormulaC16H17N5O
Molecular Weight295.35 g/mol
Exact Mass295.14
IUPAC NameN-(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)-3-pyridin-3-ylpropanamide
SMILESCc1nn(C)c2ncc(NC(=O)CCc3cccnc3)cc12
InChIInChI=1S/C16H17N5O/c1-11-14-8-13(10-18-16(14)21(2)20-11)19-15(22)6-5-12-4-3-7-17-9-12/h3-4,7-10H,5-6H2,1-2H3,(H,19,22)
InChIKeyCSWMKPVSBQUUBY-UHFFFAOYSA-N
XLogP2.24
TPSA72.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.35
LogP ≤ 52.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)-3-pyridin-3-ylpropanamide?
The IUPAC name of N-(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)-3-pyridin-3-ylpropanamide (CID 25349353) is N-(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)-3-pyridin-3-ylpropanamide.
What is the SMILES notation for N-(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)-3-pyridin-3-ylpropanamide?
The canonical SMILES for N-(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)-3-pyridin-3-ylpropanamide is Cc1nn(C)c2ncc(NC(=O)CCc3cccnc3)cc12.
What is the InChIKey of N-(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)-3-pyridin-3-ylpropanamide?
The InChIKey is CSWMKPVSBQUUBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N5O/c1-11-14-8-13(10-18-16(14)21(2)20-11)19-15(22)6-5-12-4-3-7-17-9-12/h3-4,7-10H,5-6H2,1-2H3,(H,19,22).
What are the key properties of N-(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)-3-pyridin-3-ylpropanamide?
N-(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)-3-pyridin-3-ylpropanamide has a molecular weight of 295.35 g/mol, XLogP of 2.24, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)-3-pyridin-3-ylpropanamide is sourced from PubChem (CID 25349353), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).