3-(4-fluorophenyl)-2-pyridin-4-yl-1-(2-pyrrolidin-1-ylethyl)pyrrolo[3,2-b]pyridine

C24H23FN4 — CID 11014525

IUPAC3-(4-fluorophenyl)-2-pyridin-4-yl-1-(2-pyrrolidin-1-ylethyl)pyrrolo[3,2-b]pyridine
SMILESFc1ccc(-c2c(-c3ccncc3)n(CCN3CCCC3)c3cccnc23)cc1
InChIInChI=1S/C24H23FN4/c25-20-7-5-18(6-8-20)22-23-21(4-3-11-27-23)29(17-16-28-14-1-2-15-28)24(22)19-9-12-26-13-10-19/h3-13H,1-2,14-17H2
InChIKeyFAZXNIJKIFOSSU-UHFFFAOYSA-N
MW386.47 g/mol
LogP5.00
Rot. Bonds5

About 3-(4-fluorophenyl)-2-pyridin-4-yl-1-(2-pyrrolidin-1-ylethyl)pyrrolo[3,2-b]pyridine

3-(4-fluorophenyl)-2-pyridin-4-yl-1-(2-pyrrolidin-1-ylethyl)pyrrolo[3,2-b]pyridine (PubChem CID 11014525) has the molecular formula C24H23FN4 and a molecular weight of 386.47 g/mol. Its IUPAC name is 3-(4-fluorophenyl)-2-pyridin-4-yl-1-(2-pyrrolidin-1-ylethyl)pyrrolo[3,2-b]pyridine.

Molecular Properties

Compound Name3-(4-fluorophenyl)-2-pyridin-4-yl-1-(2-pyrrolidin-1-ylethyl)pyrrolo[3,2-b]pyridine
PubChem CID11014525
Molecular FormulaC24H23FN4
Molecular Weight386.47 g/mol
Exact Mass386.19
IUPAC Name3-(4-fluorophenyl)-2-pyridin-4-yl-1-(2-pyrrolidin-1-ylethyl)pyrrolo[3,2-b]pyridine
SMILESFc1ccc(-c2c(-c3ccncc3)n(CCN3CCCC3)c3cccnc23)cc1
InChIInChI=1S/C24H23FN4/c25-20-7-5-18(6-8-20)22-23-21(4-3-11-27-23)29(17-16-28-14-1-2-15-28)24(22)19-9-12-26-13-10-19/h3-13H,1-2,14-17H2
InChIKeyFAZXNIJKIFOSSU-UHFFFAOYSA-N
XLogP5.00
TPSA33.95 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500386.47
LogP ≤ 55.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 3-(4-fluorophenyl)-2-pyridin-4-yl-1-(2-pyrrolidin-1-ylethyl)pyrrolo[3,2-b]pyridine 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 3-(4-fluorophenyl)-2-pyridin-4-yl-1-(2-pyrrolidin-1-ylethyl)pyrrolo[3,2-b]pyridine?
The IUPAC name of 3-(4-fluorophenyl)-2-pyridin-4-yl-1-(2-pyrrolidin-1-ylethyl)pyrrolo[3,2-b]pyridine (CID 11014525) is 3-(4-fluorophenyl)-2-pyridin-4-yl-1-(2-pyrrolidin-1-ylethyl)pyrrolo[3,2-b]pyridine.
What is the SMILES notation for 3-(4-fluorophenyl)-2-pyridin-4-yl-1-(2-pyrrolidin-1-ylethyl)pyrrolo[3,2-b]pyridine?
The canonical SMILES for 3-(4-fluorophenyl)-2-pyridin-4-yl-1-(2-pyrrolidin-1-ylethyl)pyrrolo[3,2-b]pyridine is Fc1ccc(-c2c(-c3ccncc3)n(CCN3CCCC3)c3cccnc23)cc1.
What is the InChIKey of 3-(4-fluorophenyl)-2-pyridin-4-yl-1-(2-pyrrolidin-1-ylethyl)pyrrolo[3,2-b]pyridine?
The InChIKey is FAZXNIJKIFOSSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23FN4/c25-20-7-5-18(6-8-20)22-23-21(4-3-11-27-23)29(17-16-28-14-1-2-15-28)24(22)19-9-12-26-13-10-19/h3-13H,1-2,14-17H2.
What are the key properties of 3-(4-fluorophenyl)-2-pyridin-4-yl-1-(2-pyrrolidin-1-ylethyl)pyrrolo[3,2-b]pyridine?
3-(4-fluorophenyl)-2-pyridin-4-yl-1-(2-pyrrolidin-1-ylethyl)pyrrolo[3,2-b]pyridine has a molecular weight of 386.47 g/mol, XLogP of 5.00, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-fluorophenyl)-2-pyridin-4-yl-1-(2-pyrrolidin-1-ylethyl)pyrrolo[3,2-b]pyridine is sourced from PubChem (CID 11014525), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).