2-(4-amino-1-ethylpyrazolo[3,4-b]pyridin-5-yl)-2-phenylacetamide

C16H17N5O — CID 57153253

IUPAC2-(4-amino-1-ethylpyrazolo[3,4-b]pyridin-5-yl)-2-phenylacetamide
SMILESCCn1ncc2c(N)c(C(C(N)=O)c3ccccc3)cnc21
InChIInChI=1S/C16H17N5O/c1-2-21-16-12(9-20-21)14(17)11(8-19-16)13(15(18)22)10-6-4-3-5-7-10/h3-9,13H,2H2,1H3,(H2,17,19)(H2,18,22)
InChIKeyOYRFPPZSSVBIRP-UHFFFAOYSA-N
MW295.35 g/mol
LogP1.65
Rot. Bonds4

About 2-(4-amino-1-ethylpyrazolo[3,4-b]pyridin-5-yl)-2-phenylacetamide

2-(4-amino-1-ethylpyrazolo[3,4-b]pyridin-5-yl)-2-phenylacetamide (PubChem CID 57153253) has the molecular formula C16H17N5O and a molecular weight of 295.35 g/mol. Its IUPAC name is 2-(4-amino-1-ethylpyrazolo[3,4-b]pyridin-5-yl)-2-phenylacetamide.

Molecular Properties

Compound Name2-(4-amino-1-ethylpyrazolo[3,4-b]pyridin-5-yl)-2-phenylacetamide
PubChem CID57153253
Molecular FormulaC16H17N5O
Molecular Weight295.35 g/mol
Exact Mass295.14
IUPAC Name2-(4-amino-1-ethylpyrazolo[3,4-b]pyridin-5-yl)-2-phenylacetamide
SMILESCCn1ncc2c(N)c(C(C(N)=O)c3ccccc3)cnc21
InChIInChI=1S/C16H17N5O/c1-2-21-16-12(9-20-21)14(17)11(8-19-16)13(15(18)22)10-6-4-3-5-7-10/h3-9,13H,2H2,1H3,(H2,17,19)(H2,18,22)
InChIKeyOYRFPPZSSVBIRP-UHFFFAOYSA-N
XLogP1.65
TPSA99.82 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.35
LogP ≤ 51.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 2-(4-amino-1-ethylpyrazolo[3,4-b]pyridin-5-yl)-2-phenylacetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-(4-amino-1-ethylpyrazolo[3,4-b]pyridin-5-yl)-2-phenylacetamide?
The IUPAC name of 2-(4-amino-1-ethylpyrazolo[3,4-b]pyridin-5-yl)-2-phenylacetamide (CID 57153253) is 2-(4-amino-1-ethylpyrazolo[3,4-b]pyridin-5-yl)-2-phenylacetamide.
What is the SMILES notation for 2-(4-amino-1-ethylpyrazolo[3,4-b]pyridin-5-yl)-2-phenylacetamide?
The canonical SMILES for 2-(4-amino-1-ethylpyrazolo[3,4-b]pyridin-5-yl)-2-phenylacetamide is CCn1ncc2c(N)c(C(C(N)=O)c3ccccc3)cnc21.
What is the InChIKey of 2-(4-amino-1-ethylpyrazolo[3,4-b]pyridin-5-yl)-2-phenylacetamide?
The InChIKey is OYRFPPZSSVBIRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N5O/c1-2-21-16-12(9-20-21)14(17)11(8-19-16)13(15(18)22)10-6-4-3-5-7-10/h3-9,13H,2H2,1H3,(H2,17,19)(H2,18,22).
What are the key properties of 2-(4-amino-1-ethylpyrazolo[3,4-b]pyridin-5-yl)-2-phenylacetamide?
2-(4-amino-1-ethylpyrazolo[3,4-b]pyridin-5-yl)-2-phenylacetamide has a molecular weight of 295.35 g/mol, XLogP of 1.65, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-amino-1-ethylpyrazolo[3,4-b]pyridin-5-yl)-2-phenylacetamide is sourced from PubChem (CID 57153253), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).