1-[5-[4-(2-methoxyphenyl)piperazin-1-yl]pentyl]-2H-pyrazolo[1,5-a]pyridine

C23H32N4O — CID 141135477

IUPAC1-[5-[4-(2-methoxyphenyl)piperazin-1-yl]pentyl]-2H-pyrazolo[1,5-a]pyridine
SMILESCOc1ccccc1N1CCN(CCCCCN2CC=C3C=CC=CN32)CC1
InChIInChI=1S/C23H32N4O/c1-28-23-11-4-3-10-22(23)25-19-17-24(18-20-25)13-6-2-7-14-26-16-12-21-9-5-8-15-27(21)26/h3-5,8-12,15H,2,6-7,13-14,16-20H2,1H3
InChIKeyJFVPAGXFRAFIJE-UHFFFAOYSA-N
MW380.54 g/mol
LogP3.49
Rot. Bonds8

About 1-[5-[4-(2-methoxyphenyl)piperazin-1-yl]pentyl]-2H-pyrazolo[1,5-a]pyridine

1-[5-[4-(2-methoxyphenyl)piperazin-1-yl]pentyl]-2H-pyrazolo[1,5-a]pyridine (PubChem CID 141135477) has the molecular formula C23H32N4O and a molecular weight of 380.54 g/mol. Its IUPAC name is 1-[5-[4-(2-methoxyphenyl)piperazin-1-yl]pentyl]-2H-pyrazolo[1,5-a]pyridine.

Molecular Properties

Compound Name1-[5-[4-(2-methoxyphenyl)piperazin-1-yl]pentyl]-2H-pyrazolo[1,5-a]pyridine
PubChem CID141135477
Molecular FormulaC23H32N4O
Molecular Weight380.54 g/mol
Exact Mass380.26
IUPAC Name1-[5-[4-(2-methoxyphenyl)piperazin-1-yl]pentyl]-2H-pyrazolo[1,5-a]pyridine
SMILESCOc1ccccc1N1CCN(CCCCCN2CC=C3C=CC=CN32)CC1
InChIInChI=1S/C23H32N4O/c1-28-23-11-4-3-10-22(23)25-19-17-24(18-20-25)13-6-2-7-14-26-16-12-21-9-5-8-15-27(21)26/h3-5,8-12,15H,2,6-7,13-14,16-20H2,1H3
InChIKeyJFVPAGXFRAFIJE-UHFFFAOYSA-N
XLogP3.49
TPSA22.19 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.54
LogP ≤ 53.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-[5-[4-(2-methoxyphenyl)piperazin-1-yl]pentyl]-2H-pyrazolo[1,5-a]pyridine?
The IUPAC name of 1-[5-[4-(2-methoxyphenyl)piperazin-1-yl]pentyl]-2H-pyrazolo[1,5-a]pyridine (CID 141135477) is 1-[5-[4-(2-methoxyphenyl)piperazin-1-yl]pentyl]-2H-pyrazolo[1,5-a]pyridine.
What is the SMILES notation for 1-[5-[4-(2-methoxyphenyl)piperazin-1-yl]pentyl]-2H-pyrazolo[1,5-a]pyridine?
The canonical SMILES for 1-[5-[4-(2-methoxyphenyl)piperazin-1-yl]pentyl]-2H-pyrazolo[1,5-a]pyridine is COc1ccccc1N1CCN(CCCCCN2CC=C3C=CC=CN32)CC1.
What is the InChIKey of 1-[5-[4-(2-methoxyphenyl)piperazin-1-yl]pentyl]-2H-pyrazolo[1,5-a]pyridine?
The InChIKey is JFVPAGXFRAFIJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H32N4O/c1-28-23-11-4-3-10-22(23)25-19-17-24(18-20-25)13-6-2-7-14-26-16-12-21-9-5-8-15-27(21)26/h3-5,8-12,15H,2,6-7,13-14,16-20H2,1H3.
What are the key properties of 1-[5-[4-(2-methoxyphenyl)piperazin-1-yl]pentyl]-2H-pyrazolo[1,5-a]pyridine?
1-[5-[4-(2-methoxyphenyl)piperazin-1-yl]pentyl]-2H-pyrazolo[1,5-a]pyridine has a molecular weight of 380.54 g/mol, XLogP of 3.49, 8 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[5-[4-(2-methoxyphenyl)piperazin-1-yl]pentyl]-2H-pyrazolo[1,5-a]pyridine is sourced from PubChem (CID 141135477), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).