5-(1-methylpyrazol-4-yl)-1-(2-pyrazolo[1,5-a]pyridin-3-ylacetyl)piperidine-3-carboxylic acid

C19H21N5O3 — CID 139020267

About 5-(1-methylpyrazol-4-yl)-1-(2-pyrazolo[1,5-a]pyridin-3-ylacetyl)piperidine-3-carboxylic acid

5-(1-methylpyrazol-4-yl)-1-(2-pyrazolo[1,5-a]pyridin-3-ylacetyl)piperidine-3-carboxylic acid (PubChem CID 139020267) has the molecular formula C19H21N5O3 and a molecular weight of 367.41 g/mol. Its IUPAC name is 5-(1-methylpyrazol-4-yl)-1-(2-pyrazolo[1,5-a]pyridin-3-ylacetyl)piperidine-3-carboxylic acid.

Molecular Properties

• Compound Name: 5-(1-methylpyrazol-4-yl)-1-(2-pyrazolo[1,5-a]pyridin-3-ylacetyl)piperidine-3-carboxylic acid
• PubChem CID: 139020267
• Molecular Formula: C19H21N5O3
• Molecular Weight: 367.41 g/mol
• Exact Mass: 367.16
• IUPAC Name: 5-(1-methylpyrazol-4-yl)-1-(2-pyrazolo[1,5-a]pyridin-3-ylacetyl)piperidine-3-carboxylic acid
• SMILES: Cn1cc(C2CC(C(=O)O)CN(C(=O)Cc3cnn4ccccc34)C2)cn1
• InChI: InChI=1S/C19H21N5O3/c1-22-10-16(9-20-22)14-6-15(19(26)27)12-23(11-14)18(25)7-13-8-21-24-5-3-2-4-17(13)24/h2-5,8-10,14-15H,6-7,11-12H2,1H3,(H,26,27)
• InChIKey: OHNMOIVOTGIUAS-UHFFFAOYSA-N
• XLogP: 1.33
• TPSA: 92.73 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 6
• Rotatable Bonds: 4
• Heavy Atoms: 27
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	367.41
LogP ≤ 5	1.33
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of 5-(1-methylpyrazol-4-yl)-1-(2-pyrazolo[1,5-a]pyridin-3-ylacetyl)piperidine-3-carboxylic acid?

The IUPAC name of 5-(1-methylpyrazol-4-yl)-1-(2-pyrazolo[1,5-a]pyridin-3-ylacetyl)piperidine-3-carboxylic acid (CID 139020267) is 5-(1-methylpyrazol-4-yl)-1-(2-pyrazolo[1,5-a]pyridin-3-ylacetyl)piperidine-3-carboxylic acid.

What is the SMILES notation for 5-(1-methylpyrazol-4-yl)-1-(2-pyrazolo[1,5-a]pyridin-3-ylacetyl)piperidine-3-carboxylic acid?

The canonical SMILES for 5-(1-methylpyrazol-4-yl)-1-(2-pyrazolo[1,5-a]pyridin-3-ylacetyl)piperidine-3-carboxylic acid is Cn1cc(C2CC(C(=O)O)CN(C(=O)Cc3cnn4ccccc34)C2)cn1.

What is the InChIKey of 5-(1-methylpyrazol-4-yl)-1-(2-pyrazolo[1,5-a]pyridin-3-ylacetyl)piperidine-3-carboxylic acid?

The InChIKey is OHNMOIVOTGIUAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N5O3/c1-22-10-16(9-20-22)14-6-15(19(26)27)12-23(11-14)18(25)7-13-8-21-24-5-3-2-4-17(13)24/h2-5,8-10,14-15H,6-7,11-12H2,1H3,(H,26,27).

What are the key properties of 5-(1-methylpyrazol-4-yl)-1-(2-pyrazolo[1,5-a]pyridin-3-ylacetyl)piperidine-3-carboxylic acid?

5-(1-methylpyrazol-4-yl)-1-(2-pyrazolo[1,5-a]pyridin-3-ylacetyl)piperidine-3-carboxylic acid has a molecular weight of 367.41 g/mol, XLogP of 1.33, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for 5-(1-methylpyrazol-4-yl)-1-(2-pyrazolo[1,5-a]pyridin-3-ylacetyl)piperidine-3-carboxylic acid is sourced from PubChem (CID 139020267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).