7-[5-(4-fluorophenyl)-1-methyl-4-pyridin-4-ylpyrazol-3-yl]-1,2,3,5,6,8a-hexahydroindolizine

C23H23FN4 — CID 10134010

IUPAC7-[5-(4-fluorophenyl)-1-methyl-4-pyridin-4-ylpyrazol-3-yl]-1,2,3,5,6,8a-hexahydroindolizine
SMILESCn1nc(C2=CC3CCCN3CC2)c(-c2ccncc2)c1-c1ccc(F)cc1
InChIInChI=1S/C23H23FN4/c1-27-23(17-4-6-19(24)7-5-17)21(16-8-11-25-12-9-16)22(26-27)18-10-14-28-13-2-3-20(28)15-18/h4-9,11-12,15,20H,2-3,10,13-14H2,1H3
InChIKeyYGDQBKRHCDNSSD-UHFFFAOYSA-N
MW374.46 g/mol
LogP4.54
Rot. Bonds3

About 7-[5-(4-fluorophenyl)-1-methyl-4-pyridin-4-ylpyrazol-3-yl]-1,2,3,5,6,8a-hexahydroindolizine

7-[5-(4-fluorophenyl)-1-methyl-4-pyridin-4-ylpyrazol-3-yl]-1,2,3,5,6,8a-hexahydroindolizine (PubChem CID 10134010) has the molecular formula C23H23FN4 and a molecular weight of 374.46 g/mol. Its IUPAC name is 7-[5-(4-fluorophenyl)-1-methyl-4-pyridin-4-ylpyrazol-3-yl]-1,2,3,5,6,8a-hexahydroindolizine.

Molecular Properties

Compound Name7-[5-(4-fluorophenyl)-1-methyl-4-pyridin-4-ylpyrazol-3-yl]-1,2,3,5,6,8a-hexahydroindolizine
PubChem CID10134010
Molecular FormulaC23H23FN4
Molecular Weight374.46 g/mol
Exact Mass374.19
IUPAC Name7-[5-(4-fluorophenyl)-1-methyl-4-pyridin-4-ylpyrazol-3-yl]-1,2,3,5,6,8a-hexahydroindolizine
SMILESCn1nc(C2=CC3CCCN3CC2)c(-c2ccncc2)c1-c1ccc(F)cc1
InChIInChI=1S/C23H23FN4/c1-27-23(17-4-6-19(24)7-5-17)21(16-8-11-25-12-9-16)22(26-27)18-10-14-28-13-2-3-20(28)15-18/h4-9,11-12,15,20H,2-3,10,13-14H2,1H3
InChIKeyYGDQBKRHCDNSSD-UHFFFAOYSA-N
XLogP4.54
TPSA33.95 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.46
LogP ≤ 54.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 7-[5-(4-fluorophenyl)-1-methyl-4-pyridin-4-ylpyrazol-3-yl]-1,2,3,5,6,8a-hexahydroindolizine 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 7-[5-(4-fluorophenyl)-1-methyl-4-pyridin-4-ylpyrazol-3-yl]-1,2,3,5,6,8a-hexahydroindolizine?
The IUPAC name of 7-[5-(4-fluorophenyl)-1-methyl-4-pyridin-4-ylpyrazol-3-yl]-1,2,3,5,6,8a-hexahydroindolizine (CID 10134010) is 7-[5-(4-fluorophenyl)-1-methyl-4-pyridin-4-ylpyrazol-3-yl]-1,2,3,5,6,8a-hexahydroindolizine.
What is the SMILES notation for 7-[5-(4-fluorophenyl)-1-methyl-4-pyridin-4-ylpyrazol-3-yl]-1,2,3,5,6,8a-hexahydroindolizine?
The canonical SMILES for 7-[5-(4-fluorophenyl)-1-methyl-4-pyridin-4-ylpyrazol-3-yl]-1,2,3,5,6,8a-hexahydroindolizine is Cn1nc(C2=CC3CCCN3CC2)c(-c2ccncc2)c1-c1ccc(F)cc1.
What is the InChIKey of 7-[5-(4-fluorophenyl)-1-methyl-4-pyridin-4-ylpyrazol-3-yl]-1,2,3,5,6,8a-hexahydroindolizine?
The InChIKey is YGDQBKRHCDNSSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23FN4/c1-27-23(17-4-6-19(24)7-5-17)21(16-8-11-25-12-9-16)22(26-27)18-10-14-28-13-2-3-20(28)15-18/h4-9,11-12,15,20H,2-3,10,13-14H2,1H3.
What are the key properties of 7-[5-(4-fluorophenyl)-1-methyl-4-pyridin-4-ylpyrazol-3-yl]-1,2,3,5,6,8a-hexahydroindolizine?
7-[5-(4-fluorophenyl)-1-methyl-4-pyridin-4-ylpyrazol-3-yl]-1,2,3,5,6,8a-hexahydroindolizine has a molecular weight of 374.46 g/mol, XLogP of 4.54, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[5-(4-fluorophenyl)-1-methyl-4-pyridin-4-ylpyrazol-3-yl]-1,2,3,5,6,8a-hexahydroindolizine is sourced from PubChem (CID 10134010), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).