5-(1-methyl-6,7-dihydro-4H-pyrazolo[4,5-c]pyridin-5-yl)imidazo[1,2-c]pyrimidine-7-carboxylic acid

C14H14N6O2 — CID 167780587

About 5-(1-methyl-6,7-dihydro-4H-pyrazolo[4,5-c]pyridin-5-yl)imidazo[1,2-c]pyrimidine-7-carboxylic acid

5-(1-methyl-6,7-dihydro-4H-pyrazolo[4,5-c]pyridin-5-yl)imidazo[1,2-c]pyrimidine-7-carboxylic acid (PubChem CID 167780587) has the molecular formula C14H14N6O2 and a molecular weight of 298.31 g/mol. Its IUPAC name is 5-(1-methyl-6,7-dihydro-4H-pyrazolo[4,5-c]pyridin-5-yl)imidazo[1,2-c]pyrimidine-7-carboxylic acid.

Molecular Properties

• Compound Name: 5-(1-methyl-6,7-dihydro-4H-pyrazolo[4,5-c]pyridin-5-yl)imidazo[1,2-c]pyrimidine-7-carboxylic acid
• PubChem CID: 167780587
• Molecular Formula: C14H14N6O2
• Molecular Weight: 298.31 g/mol
• Exact Mass: 298.12
• IUPAC Name: 5-(1-methyl-6,7-dihydro-4H-pyrazolo[4,5-c]pyridin-5-yl)imidazo[1,2-c]pyrimidine-7-carboxylic acid
• SMILES: Cn1ncc2c1CCN(c1nc(C(=O)O)cc3nccn13)C2
• InChI: InChI=1S/C14H14N6O2/c1-18-11-2-4-19(8-9(11)7-16-18)14-17-10(13(21)22)6-12-15-3-5-20(12)14/h3,5-7H,2,4,8H2,1H3,(H,21,22)
• InChIKey: ODPKJBUYJZDJDC-UHFFFAOYSA-N
• XLogP: 0.72
• TPSA: 88.55 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 7
• Rotatable Bonds: 2
• Heavy Atoms: 22
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	298.31
LogP ≤ 5	0.72
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	7

Frequently Asked Questions

What is the IUPAC name of 5-(1-methyl-6,7-dihydro-4H-pyrazolo[4,5-c]pyridin-5-yl)imidazo[1,2-c]pyrimidine-7-carboxylic acid?

The IUPAC name of 5-(1-methyl-6,7-dihydro-4H-pyrazolo[4,5-c]pyridin-5-yl)imidazo[1,2-c]pyrimidine-7-carboxylic acid (CID 167780587) is 5-(1-methyl-6,7-dihydro-4H-pyrazolo[4,5-c]pyridin-5-yl)imidazo[1,2-c]pyrimidine-7-carboxylic acid.

What is the SMILES notation for 5-(1-methyl-6,7-dihydro-4H-pyrazolo[4,5-c]pyridin-5-yl)imidazo[1,2-c]pyrimidine-7-carboxylic acid?

The canonical SMILES for 5-(1-methyl-6,7-dihydro-4H-pyrazolo[4,5-c]pyridin-5-yl)imidazo[1,2-c]pyrimidine-7-carboxylic acid is Cn1ncc2c1CCN(c1nc(C(=O)O)cc3nccn13)C2.

What is the InChIKey of 5-(1-methyl-6,7-dihydro-4H-pyrazolo[4,5-c]pyridin-5-yl)imidazo[1,2-c]pyrimidine-7-carboxylic acid?

The InChIKey is ODPKJBUYJZDJDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N6O2/c1-18-11-2-4-19(8-9(11)7-16-18)14-17-10(13(21)22)6-12-15-3-5-20(12)14/h3,5-7H,2,4,8H2,1H3,(H,21,22).

What are the key properties of 5-(1-methyl-6,7-dihydro-4H-pyrazolo[4,5-c]pyridin-5-yl)imidazo[1,2-c]pyrimidine-7-carboxylic acid?

5-(1-methyl-6,7-dihydro-4H-pyrazolo[4,5-c]pyridin-5-yl)imidazo[1,2-c]pyrimidine-7-carboxylic acid has a molecular weight of 298.31 g/mol, XLogP of 0.72, 2 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.

Where does this data come from?

All data for 5-(1-methyl-6,7-dihydro-4H-pyrazolo[4,5-c]pyridin-5-yl)imidazo[1,2-c]pyrimidine-7-carboxylic acid is sourced from PubChem (CID 167780587), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).