1-[2-(4-fluorophenyl)pyrazolo[1,5-a]pyrazin-4-yl]-N-phenylpiperidine-4-carboxamide

C24H22FN5O — CID 50743446

IUPAC1-[2-(4-fluorophenyl)pyrazolo[1,5-a]pyrazin-4-yl]-N-phenylpiperidine-4-carboxamide
SMILESO=C(Nc1ccccc1)C1CCN(c2nccn3nc(-c4ccc(F)cc4)cc23)CC1
InChIInChI=1S/C24H22FN5O/c25-19-8-6-17(7-9-19)21-16-22-23(26-12-15-30(22)28-21)29-13-10-18(11-14-29)24(31)27-20-4-2-1-3-5-20/h1-9,12,15-16,18H,10-11,13-14H2,(H,27,31)
InChIKeyPMMFMQCSUZFCMT-UHFFFAOYSA-N
MW415.47 g/mol
LogP4.39
Rot. Bonds4

About 1-[2-(4-fluorophenyl)pyrazolo[1,5-a]pyrazin-4-yl]-N-phenylpiperidine-4-carboxamide

1-[2-(4-fluorophenyl)pyrazolo[1,5-a]pyrazin-4-yl]-N-phenylpiperidine-4-carboxamide (PubChem CID 50743446) has the molecular formula C24H22FN5O and a molecular weight of 415.47 g/mol. Its IUPAC name is 1-[2-(4-fluorophenyl)pyrazolo[1,5-a]pyrazin-4-yl]-N-phenylpiperidine-4-carboxamide.

Molecular Properties

Compound Name1-[2-(4-fluorophenyl)pyrazolo[1,5-a]pyrazin-4-yl]-N-phenylpiperidine-4-carboxamide
PubChem CID50743446
Molecular FormulaC24H22FN5O
Molecular Weight415.47 g/mol
Exact Mass415.18
IUPAC Name1-[2-(4-fluorophenyl)pyrazolo[1,5-a]pyrazin-4-yl]-N-phenylpiperidine-4-carboxamide
SMILESO=C(Nc1ccccc1)C1CCN(c2nccn3nc(-c4ccc(F)cc4)cc23)CC1
InChIInChI=1S/C24H22FN5O/c25-19-8-6-17(7-9-19)21-16-22-23(26-12-15-30(22)28-21)29-13-10-18(11-14-29)24(31)27-20-4-2-1-3-5-20/h1-9,12,15-16,18H,10-11,13-14H2,(H,27,31)
InChIKeyPMMFMQCSUZFCMT-UHFFFAOYSA-N
XLogP4.39
TPSA62.53 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500415.47
LogP ≤ 54.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 1-[2-(4-fluorophenyl)pyrazolo[1,5-a]pyrazin-4-yl]-N-phenylpiperidine-4-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-[2-(4-fluorophenyl)pyrazolo[1,5-a]pyrazin-4-yl]-N-phenylpiperidine-4-carboxamide?
The IUPAC name of 1-[2-(4-fluorophenyl)pyrazolo[1,5-a]pyrazin-4-yl]-N-phenylpiperidine-4-carboxamide (CID 50743446) is 1-[2-(4-fluorophenyl)pyrazolo[1,5-a]pyrazin-4-yl]-N-phenylpiperidine-4-carboxamide.
What is the SMILES notation for 1-[2-(4-fluorophenyl)pyrazolo[1,5-a]pyrazin-4-yl]-N-phenylpiperidine-4-carboxamide?
The canonical SMILES for 1-[2-(4-fluorophenyl)pyrazolo[1,5-a]pyrazin-4-yl]-N-phenylpiperidine-4-carboxamide is O=C(Nc1ccccc1)C1CCN(c2nccn3nc(-c4ccc(F)cc4)cc23)CC1.
What is the InChIKey of 1-[2-(4-fluorophenyl)pyrazolo[1,5-a]pyrazin-4-yl]-N-phenylpiperidine-4-carboxamide?
The InChIKey is PMMFMQCSUZFCMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H22FN5O/c25-19-8-6-17(7-9-19)21-16-22-23(26-12-15-30(22)28-21)29-13-10-18(11-14-29)24(31)27-20-4-2-1-3-5-20/h1-9,12,15-16,18H,10-11,13-14H2,(H,27,31).
What are the key properties of 1-[2-(4-fluorophenyl)pyrazolo[1,5-a]pyrazin-4-yl]-N-phenylpiperidine-4-carboxamide?
1-[2-(4-fluorophenyl)pyrazolo[1,5-a]pyrazin-4-yl]-N-phenylpiperidine-4-carboxamide has a molecular weight of 415.47 g/mol, XLogP of 4.39, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(4-fluorophenyl)pyrazolo[1,5-a]pyrazin-4-yl]-N-phenylpiperidine-4-carboxamide is sourced from PubChem (CID 50743446), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).