1-(cyclopropylmethyl)-5-[3-(4-methylphenyl)propanoyl]-N-(pyridin-2-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide

C27H31N5O2 — CID 26143371

About 1-(cyclopropylmethyl)-5-[3-(4-methylphenyl)propanoyl]-N-(pyridin-2-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide

1-(cyclopropylmethyl)-5-[3-(4-methylphenyl)propanoyl]-N-(pyridin-2-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide (PubChem CID 26143371) has the molecular formula C27H31N5O2 and a molecular weight of 457.58 g/mol. Its IUPAC name is 1-(cyclopropylmethyl)-5-[3-(4-methylphenyl)propanoyl]-N-(pyridin-2-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide.

Molecular Properties

• Compound Name: 1-(cyclopropylmethyl)-5-[3-(4-methylphenyl)propanoyl]-N-(pyridin-2-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide
• PubChem CID: 26143371
• Molecular Formula: C27H31N5O2
• Molecular Weight: 457.58 g/mol
• Exact Mass: 457.25
• IUPAC Name: 1-(cyclopropylmethyl)-5-[3-(4-methylphenyl)propanoyl]-N-(pyridin-2-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide
• SMILES: Cc1ccc(CCC(=O)N2CCc3c(c(C(=O)NCc4ccccn4)nn3CC3CC3)C2)cc1
• InChI: InChI=1S/C27H31N5O2/c1-19-5-7-20(8-6-19)11-12-25(33)31-15-13-24-23(18-31)26(30-32(24)17-21-9-10-21)27(34)29-16-22-4-2-3-14-28-22/h2-8,14,21H,9-13,15-18H2,1H3,(H,29,34)
• InChIKey: OFPNNDSVVFCLBN-UHFFFAOYSA-N
• XLogP: 3.44
• TPSA: 80.12 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 5
• Rotatable Bonds: 8
• Heavy Atoms: 34
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	457.58
LogP ≤ 5	3.44
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

What is the IUPAC name of 1-(cyclopropylmethyl)-5-[3-(4-methylphenyl)propanoyl]-N-(pyridin-2-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide?

The IUPAC name of 1-(cyclopropylmethyl)-5-[3-(4-methylphenyl)propanoyl]-N-(pyridin-2-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide (CID 26143371) is 1-(cyclopropylmethyl)-5-[3-(4-methylphenyl)propanoyl]-N-(pyridin-2-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide.

What is the SMILES notation for 1-(cyclopropylmethyl)-5-[3-(4-methylphenyl)propanoyl]-N-(pyridin-2-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide?

The canonical SMILES for 1-(cyclopropylmethyl)-5-[3-(4-methylphenyl)propanoyl]-N-(pyridin-2-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide is Cc1ccc(CCC(=O)N2CCc3c(c(C(=O)NCc4ccccn4)nn3CC3CC3)C2)cc1.

What is the InChIKey of 1-(cyclopropylmethyl)-5-[3-(4-methylphenyl)propanoyl]-N-(pyridin-2-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide?

The InChIKey is OFPNNDSVVFCLBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H31N5O2/c1-19-5-7-20(8-6-19)11-12-25(33)31-15-13-24-23(18-31)26(30-32(24)17-21-9-10-21)27(34)29-16-22-4-2-3-14-28-22/h2-8,14,21H,9-13,15-18H2,1H3,(H,29,34).

What are the key properties of 1-(cyclopropylmethyl)-5-[3-(4-methylphenyl)propanoyl]-N-(pyridin-2-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide?

1-(cyclopropylmethyl)-5-[3-(4-methylphenyl)propanoyl]-N-(pyridin-2-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide has a molecular weight of 457.58 g/mol, XLogP of 3.44, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 1-(cyclopropylmethyl)-5-[3-(4-methylphenyl)propanoyl]-N-(pyridin-2-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide is sourced from PubChem (CID 26143371), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).