2-methyl-5-(3-phenylpropanoyl)-N-(pyridin-2-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-7-carboxamide

C23H25N5O2 — CID 110248137

About 2-methyl-5-(3-phenylpropanoyl)-N-(pyridin-2-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-7-carboxamide

2-methyl-5-(3-phenylpropanoyl)-N-(pyridin-2-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-7-carboxamide (PubChem CID 110248137) has the molecular formula C23H25N5O2 and a molecular weight of 403.49 g/mol. Its IUPAC name is 2-methyl-5-(3-phenylpropanoyl)-N-(pyridin-2-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-7-carboxamide.

Molecular Properties

• Compound Name: 2-methyl-5-(3-phenylpropanoyl)-N-(pyridin-2-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-7-carboxamide
• PubChem CID: 110248137
• Molecular Formula: C23H25N5O2
• Molecular Weight: 403.49 g/mol
• Exact Mass: 403.20
• IUPAC Name: 2-methyl-5-(3-phenylpropanoyl)-N-(pyridin-2-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-7-carboxamide
• SMILES: Cn1cc2c(n1)C(C(=O)NCc1ccccn1)CN(C(=O)CCc1ccccc1)C2
• InChI: InChI=1S/C23H25N5O2/c1-27-14-18-15-28(21(29)11-10-17-7-3-2-4-8-17)16-20(22(18)26-27)23(30)25-13-19-9-5-6-12-24-19/h2-9,12,14,20H,10-11,13,15-16H2,1H3,(H,25,30)
• InChIKey: ZZTDJAYPLFXYIF-UHFFFAOYSA-N
• XLogP: 2.19
• TPSA: 80.12 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 5
• Rotatable Bonds: 6
• Heavy Atoms: 30
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	403.49
LogP ≤ 5	2.19
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

What is the IUPAC name of 2-methyl-5-(3-phenylpropanoyl)-N-(pyridin-2-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-7-carboxamide?

The IUPAC name of 2-methyl-5-(3-phenylpropanoyl)-N-(pyridin-2-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-7-carboxamide (CID 110248137) is 2-methyl-5-(3-phenylpropanoyl)-N-(pyridin-2-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-7-carboxamide.

What is the SMILES notation for 2-methyl-5-(3-phenylpropanoyl)-N-(pyridin-2-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-7-carboxamide?

The canonical SMILES for 2-methyl-5-(3-phenylpropanoyl)-N-(pyridin-2-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-7-carboxamide is Cn1cc2c(n1)C(C(=O)NCc1ccccn1)CN(C(=O)CCc1ccccc1)C2.

What is the InChIKey of 2-methyl-5-(3-phenylpropanoyl)-N-(pyridin-2-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-7-carboxamide?

The InChIKey is ZZTDJAYPLFXYIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25N5O2/c1-27-14-18-15-28(21(29)11-10-17-7-3-2-4-8-17)16-20(22(18)26-27)23(30)25-13-19-9-5-6-12-24-19/h2-9,12,14,20H,10-11,13,15-16H2,1H3,(H,25,30).

What are the key properties of 2-methyl-5-(3-phenylpropanoyl)-N-(pyridin-2-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-7-carboxamide?

2-methyl-5-(3-phenylpropanoyl)-N-(pyridin-2-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-7-carboxamide has a molecular weight of 403.49 g/mol, XLogP of 2.19, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 2-methyl-5-(3-phenylpropanoyl)-N-(pyridin-2-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-7-carboxamide is sourced from PubChem (CID 110248137), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).