methyl 2-(4-methoxyphenyl)-3-oxo-5-(1H-pyrazol-5-yl)pyrazolo[4,3-c]pyridine-7-carboxylate

C18H15N5O4 — CID 66495852

About methyl 2-(4-methoxyphenyl)-3-oxo-5-(1H-pyrazol-5-yl)pyrazolo[4,3-c]pyridine-7-carboxylate

methyl 2-(4-methoxyphenyl)-3-oxo-5-(1H-pyrazol-5-yl)pyrazolo[4,3-c]pyridine-7-carboxylate (PubChem CID 66495852) has the molecular formula C18H15N5O4 and a molecular weight of 365.35 g/mol. Its IUPAC name is methyl 2-(4-methoxyphenyl)-3-oxo-5-(1H-pyrazol-5-yl)pyrazolo[4,3-c]pyridine-7-carboxylate.

Molecular Properties

• Compound Name: methyl 2-(4-methoxyphenyl)-3-oxo-5-(1H-pyrazol-5-yl)pyrazolo[4,3-c]pyridine-7-carboxylate
• PubChem CID: 66495852
• Molecular Formula: C18H15N5O4
• Molecular Weight: 365.35 g/mol
• Exact Mass: 365.11
• IUPAC Name: methyl 2-(4-methoxyphenyl)-3-oxo-5-(1H-pyrazol-5-yl)pyrazolo[4,3-c]pyridine-7-carboxylate
• SMILES: COC(=O)c1cn(-c2ccn[nH]2)cc2c(=O)n(-c3ccc(OC)cc3)nc1-2
• InChI: InChI=1S/C18H15N5O4/c1-26-12-5-3-11(4-6-12)23-17(24)13-9-22(15-7-8-19-20-15)10-14(16(13)21-23)18(25)27-2/h3-10H,1-2H3,(H,19,20)
• InChIKey: ZGQDNZWXIWEFJF-UHFFFAOYSA-N
• XLogP: 1.65
• TPSA: 104.03 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 8
• Rotatable Bonds: 4
• Heavy Atoms: 27
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	365.35
LogP ≤ 5	1.65
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	8

Frequently Asked Questions

What is the IUPAC name of methyl 2-(4-methoxyphenyl)-3-oxo-5-(1H-pyrazol-5-yl)pyrazolo[4,3-c]pyridine-7-carboxylate?

The IUPAC name of methyl 2-(4-methoxyphenyl)-3-oxo-5-(1H-pyrazol-5-yl)pyrazolo[4,3-c]pyridine-7-carboxylate (CID 66495852) is methyl 2-(4-methoxyphenyl)-3-oxo-5-(1H-pyrazol-5-yl)pyrazolo[4,3-c]pyridine-7-carboxylate.

What is the SMILES notation for methyl 2-(4-methoxyphenyl)-3-oxo-5-(1H-pyrazol-5-yl)pyrazolo[4,3-c]pyridine-7-carboxylate?

The canonical SMILES for methyl 2-(4-methoxyphenyl)-3-oxo-5-(1H-pyrazol-5-yl)pyrazolo[4,3-c]pyridine-7-carboxylate is COC(=O)c1cn(-c2ccn[nH]2)cc2c(=O)n(-c3ccc(OC)cc3)nc1-2.

What is the InChIKey of methyl 2-(4-methoxyphenyl)-3-oxo-5-(1H-pyrazol-5-yl)pyrazolo[4,3-c]pyridine-7-carboxylate?

The InChIKey is ZGQDNZWXIWEFJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15N5O4/c1-26-12-5-3-11(4-6-12)23-17(24)13-9-22(15-7-8-19-20-15)10-14(16(13)21-23)18(25)27-2/h3-10H,1-2H3,(H,19,20).

What are the key properties of methyl 2-(4-methoxyphenyl)-3-oxo-5-(1H-pyrazol-5-yl)pyrazolo[4,3-c]pyridine-7-carboxylate?

methyl 2-(4-methoxyphenyl)-3-oxo-5-(1H-pyrazol-5-yl)pyrazolo[4,3-c]pyridine-7-carboxylate has a molecular weight of 365.35 g/mol, XLogP of 1.65, 4 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.

Where does this data come from?

All data for methyl 2-(4-methoxyphenyl)-3-oxo-5-(1H-pyrazol-5-yl)pyrazolo[4,3-c]pyridine-7-carboxylate is sourced from PubChem (CID 66495852), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).