2-[2-methoxy-5-(1-methyl-6-oxo-5,7-dihydro-4H-pyrazolo[5,4-b]pyridin-4-yl)phenoxy]acetamide

C16H18N4O4 — CID 135632346

IUPAC2-[2-methoxy-5-(1-methyl-6-oxo-5,7-dihydro-4H-pyrazolo[5,4-b]pyridin-4-yl)phenoxy]acetamide
SMILESCOc1ccc(C2CC(=O)Nc3c2cnn3C)cc1OCC(N)=O
InChIInChI=1S/C16H18N4O4/c1-20-16-11(7-18-20)10(6-15(22)19-16)9-3-4-12(23-2)13(5-9)24-8-14(17)21/h3-5,7,10H,6,8H2,1-2H3,(H2,17,21)(H,19,22)
InChIKeyOMPBMUHFCISQEC-UHFFFAOYSA-N
MW330.34 g/mol
LogP0.77
Rot. Bonds5

About 2-[2-methoxy-5-(1-methyl-6-oxo-5,7-dihydro-4H-pyrazolo[5,4-b]pyridin-4-yl)phenoxy]acetamide

2-[2-methoxy-5-(1-methyl-6-oxo-5,7-dihydro-4H-pyrazolo[5,4-b]pyridin-4-yl)phenoxy]acetamide (PubChem CID 135632346) has the molecular formula C16H18N4O4 and a molecular weight of 330.34 g/mol. Its IUPAC name is 2-[2-methoxy-5-(1-methyl-6-oxo-5,7-dihydro-4H-pyrazolo[5,4-b]pyridin-4-yl)phenoxy]acetamide.

Molecular Properties

Compound Name2-[2-methoxy-5-(1-methyl-6-oxo-5,7-dihydro-4H-pyrazolo[5,4-b]pyridin-4-yl)phenoxy]acetamide
PubChem CID135632346
Molecular FormulaC16H18N4O4
Molecular Weight330.34 g/mol
Exact Mass330.13
IUPAC Name2-[2-methoxy-5-(1-methyl-6-oxo-5,7-dihydro-4H-pyrazolo[5,4-b]pyridin-4-yl)phenoxy]acetamide
SMILESCOc1ccc(C2CC(=O)Nc3c2cnn3C)cc1OCC(N)=O
InChIInChI=1S/C16H18N4O4/c1-20-16-11(7-18-20)10(6-15(22)19-16)9-3-4-12(23-2)13(5-9)24-8-14(17)21/h3-5,7,10H,6,8H2,1-2H3,(H2,17,21)(H,19,22)
InChIKeyOMPBMUHFCISQEC-UHFFFAOYSA-N
XLogP0.77
TPSA108.47 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.34
LogP ≤ 50.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 2-[2-methoxy-5-(1-methyl-6-oxo-5,7-dihydro-4H-pyrazolo[5,4-b]pyridin-4-yl)phenoxy]acetamide 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-[2-methoxy-5-(1-methyl-6-oxo-5,7-dihydro-4H-pyrazolo[5,4-b]pyridin-4-yl)phenoxy]acetamide?
The IUPAC name of 2-[2-methoxy-5-(1-methyl-6-oxo-5,7-dihydro-4H-pyrazolo[5,4-b]pyridin-4-yl)phenoxy]acetamide (CID 135632346) is 2-[2-methoxy-5-(1-methyl-6-oxo-5,7-dihydro-4H-pyrazolo[5,4-b]pyridin-4-yl)phenoxy]acetamide.
What is the SMILES notation for 2-[2-methoxy-5-(1-methyl-6-oxo-5,7-dihydro-4H-pyrazolo[5,4-b]pyridin-4-yl)phenoxy]acetamide?
The canonical SMILES for 2-[2-methoxy-5-(1-methyl-6-oxo-5,7-dihydro-4H-pyrazolo[5,4-b]pyridin-4-yl)phenoxy]acetamide is COc1ccc(C2CC(=O)Nc3c2cnn3C)cc1OCC(N)=O.
What is the InChIKey of 2-[2-methoxy-5-(1-methyl-6-oxo-5,7-dihydro-4H-pyrazolo[5,4-b]pyridin-4-yl)phenoxy]acetamide?
The InChIKey is OMPBMUHFCISQEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N4O4/c1-20-16-11(7-18-20)10(6-15(22)19-16)9-3-4-12(23-2)13(5-9)24-8-14(17)21/h3-5,7,10H,6,8H2,1-2H3,(H2,17,21)(H,19,22).
What are the key properties of 2-[2-methoxy-5-(1-methyl-6-oxo-5,7-dihydro-4H-pyrazolo[5,4-b]pyridin-4-yl)phenoxy]acetamide?
2-[2-methoxy-5-(1-methyl-6-oxo-5,7-dihydro-4H-pyrazolo[5,4-b]pyridin-4-yl)phenoxy]acetamide has a molecular weight of 330.34 g/mol, XLogP of 0.77, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-methoxy-5-(1-methyl-6-oxo-5,7-dihydro-4H-pyrazolo[5,4-b]pyridin-4-yl)phenoxy]acetamide is sourced from PubChem (CID 135632346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).