5-cyclobutyl-N-[(1-ethylpyrrolidin-2-yl)methyl]-1-(2-methoxyethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide

C21H35N5O2 — CID 45165107

About 5-cyclobutyl-N-[(1-ethylpyrrolidin-2-yl)methyl]-1-(2-methoxyethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide

5-cyclobutyl-N-[(1-ethylpyrrolidin-2-yl)methyl]-1-(2-methoxyethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide (PubChem CID 45165107) has the molecular formula C21H35N5O2 and a molecular weight of 389.54 g/mol. Its IUPAC name is 5-cyclobutyl-N-[(1-ethylpyrrolidin-2-yl)methyl]-1-(2-methoxyethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide.

Molecular Properties

• Compound Name: 5-cyclobutyl-N-[(1-ethylpyrrolidin-2-yl)methyl]-1-(2-methoxyethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide
• PubChem CID: 45165107
• Molecular Formula: C21H35N5O2
• Molecular Weight: 389.54 g/mol
• Exact Mass: 389.28
• IUPAC Name: 5-cyclobutyl-N-[(1-ethylpyrrolidin-2-yl)methyl]-1-(2-methoxyethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide
• SMILES: CCN1CCCC1CNC(=O)c1nn(CCOC)c2c1CN(C1CCC1)CC2
• InChI: InChI=1S/C21H35N5O2/c1-3-24-10-5-8-17(24)14-22-21(27)20-18-15-25(16-6-4-7-16)11-9-19(18)26(23-20)12-13-28-2/h16-17H,3-15H2,1-2H3,(H,22,27)
• InChIKey: GSWRBMLXHQMGDP-UHFFFAOYSA-N
• XLogP: 1.65
• TPSA: 62.63 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 6
• Rotatable Bonds: 8
• Heavy Atoms: 28
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	389.54
LogP ≤ 5	1.65
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of 5-cyclobutyl-N-[(1-ethylpyrrolidin-2-yl)methyl]-1-(2-methoxyethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide?

The IUPAC name of 5-cyclobutyl-N-[(1-ethylpyrrolidin-2-yl)methyl]-1-(2-methoxyethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide (CID 45165107) is 5-cyclobutyl-N-[(1-ethylpyrrolidin-2-yl)methyl]-1-(2-methoxyethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide.

What is the SMILES notation for 5-cyclobutyl-N-[(1-ethylpyrrolidin-2-yl)methyl]-1-(2-methoxyethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide?

The canonical SMILES for 5-cyclobutyl-N-[(1-ethylpyrrolidin-2-yl)methyl]-1-(2-methoxyethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide is CCN1CCCC1CNC(=O)c1nn(CCOC)c2c1CN(C1CCC1)CC2.

What is the InChIKey of 5-cyclobutyl-N-[(1-ethylpyrrolidin-2-yl)methyl]-1-(2-methoxyethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide?

The InChIKey is GSWRBMLXHQMGDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H35N5O2/c1-3-24-10-5-8-17(24)14-22-21(27)20-18-15-25(16-6-4-7-16)11-9-19(18)26(23-20)12-13-28-2/h16-17H,3-15H2,1-2H3,(H,22,27).

What are the key properties of 5-cyclobutyl-N-[(1-ethylpyrrolidin-2-yl)methyl]-1-(2-methoxyethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide?

5-cyclobutyl-N-[(1-ethylpyrrolidin-2-yl)methyl]-1-(2-methoxyethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide has a molecular weight of 389.54 g/mol, XLogP of 1.65, 8 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for 5-cyclobutyl-N-[(1-ethylpyrrolidin-2-yl)methyl]-1-(2-methoxyethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide is sourced from PubChem (CID 45165107), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).