5-[[[2-(4-acetylphenoxy)acetyl]-methylamino]methyl]pyrazolo[1,5-a]pyridine-3-carboxamide

C20H20N4O4 — CID 170752901

IUPAC5-[[[2-(4-acetylphenoxy)acetyl]-methylamino]methyl]pyrazolo[1,5-a]pyridine-3-carboxamide
SMILESCC(=O)c1ccc(OCC(=O)N(C)Cc2ccn3ncc(C(N)=O)c3c2)cc1
InChIInChI=1S/C20H20N4O4/c1-13(25)15-3-5-16(6-4-15)28-12-19(26)23(2)11-14-7-8-24-18(9-14)17(10-22-24)20(21)27/h3-10H,11-12H2,1-2H3,(H2,21,27)
InChIKeyYUVGWTKVHBUCJL-UHFFFAOYSA-N
MW380.40 g/mol
LogP1.67
Rot. Bonds7

About 5-[[[2-(4-acetylphenoxy)acetyl]-methylamino]methyl]pyrazolo[1,5-a]pyridine-3-carboxamide

5-[[[2-(4-acetylphenoxy)acetyl]-methylamino]methyl]pyrazolo[1,5-a]pyridine-3-carboxamide (PubChem CID 170752901) has the molecular formula C20H20N4O4 and a molecular weight of 380.40 g/mol. Its IUPAC name is 5-[[[2-(4-acetylphenoxy)acetyl]-methylamino]methyl]pyrazolo[1,5-a]pyridine-3-carboxamide.

Molecular Properties

Compound Name5-[[[2-(4-acetylphenoxy)acetyl]-methylamino]methyl]pyrazolo[1,5-a]pyridine-3-carboxamide
PubChem CID170752901
Molecular FormulaC20H20N4O4
Molecular Weight380.40 g/mol
Exact Mass380.15
IUPAC Name5-[[[2-(4-acetylphenoxy)acetyl]-methylamino]methyl]pyrazolo[1,5-a]pyridine-3-carboxamide
SMILESCC(=O)c1ccc(OCC(=O)N(C)Cc2ccn3ncc(C(N)=O)c3c2)cc1
InChIInChI=1S/C20H20N4O4/c1-13(25)15-3-5-16(6-4-15)28-12-19(26)23(2)11-14-7-8-24-18(9-14)17(10-22-24)20(21)27/h3-10H,11-12H2,1-2H3,(H2,21,27)
InChIKeyYUVGWTKVHBUCJL-UHFFFAOYSA-N
XLogP1.67
TPSA107.00 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.40
LogP ≤ 51.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 5-[[[2-(4-acetylphenoxy)acetyl]-methylamino]methyl]pyrazolo[1,5-a]pyridine-3-carboxamide?
The IUPAC name of 5-[[[2-(4-acetylphenoxy)acetyl]-methylamino]methyl]pyrazolo[1,5-a]pyridine-3-carboxamide (CID 170752901) is 5-[[[2-(4-acetylphenoxy)acetyl]-methylamino]methyl]pyrazolo[1,5-a]pyridine-3-carboxamide.
What is the SMILES notation for 5-[[[2-(4-acetylphenoxy)acetyl]-methylamino]methyl]pyrazolo[1,5-a]pyridine-3-carboxamide?
The canonical SMILES for 5-[[[2-(4-acetylphenoxy)acetyl]-methylamino]methyl]pyrazolo[1,5-a]pyridine-3-carboxamide is CC(=O)c1ccc(OCC(=O)N(C)Cc2ccn3ncc(C(N)=O)c3c2)cc1.
What is the InChIKey of 5-[[[2-(4-acetylphenoxy)acetyl]-methylamino]methyl]pyrazolo[1,5-a]pyridine-3-carboxamide?
The InChIKey is YUVGWTKVHBUCJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N4O4/c1-13(25)15-3-5-16(6-4-15)28-12-19(26)23(2)11-14-7-8-24-18(9-14)17(10-22-24)20(21)27/h3-10H,11-12H2,1-2H3,(H2,21,27).
What are the key properties of 5-[[[2-(4-acetylphenoxy)acetyl]-methylamino]methyl]pyrazolo[1,5-a]pyridine-3-carboxamide?
5-[[[2-(4-acetylphenoxy)acetyl]-methylamino]methyl]pyrazolo[1,5-a]pyridine-3-carboxamide has a molecular weight of 380.40 g/mol, XLogP of 1.67, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[[[2-(4-acetylphenoxy)acetyl]-methylamino]methyl]pyrazolo[1,5-a]pyridine-3-carboxamide is sourced from PubChem (CID 170752901), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).