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

C18H12FN3 — CID 11833097

IUPAC3-(4-fluorophenyl)-2-pyridin-4-yl-1H-pyrrolo[3,2-b]pyridine
SMILESFc1ccc(-c2c(-c3ccncc3)[nH]c3cccnc23)cc1
InChIInChI=1S/C18H12FN3/c19-14-5-3-12(4-6-14)16-17(13-7-10-20-11-8-13)22-15-2-1-9-21-18(15)16/h1-11,22H
InChIKeyDPGNJQAIOXNWEY-UHFFFAOYSA-N
MW289.31 g/mol
LogP4.43
Rot. Bonds2

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

3-(4-fluorophenyl)-2-pyridin-4-yl-1H-pyrrolo[3,2-b]pyridine (PubChem CID 11833097) has the molecular formula C18H12FN3 and a molecular weight of 289.31 g/mol. Its IUPAC name is 3-(4-fluorophenyl)-2-pyridin-4-yl-1H-pyrrolo[3,2-b]pyridine.

Molecular Properties

Compound Name3-(4-fluorophenyl)-2-pyridin-4-yl-1H-pyrrolo[3,2-b]pyridine
PubChem CID11833097
Molecular FormulaC18H12FN3
Molecular Weight289.31 g/mol
Exact Mass289.10
IUPAC Name3-(4-fluorophenyl)-2-pyridin-4-yl-1H-pyrrolo[3,2-b]pyridine
SMILESFc1ccc(-c2c(-c3ccncc3)[nH]c3cccnc23)cc1
InChIInChI=1S/C18H12FN3/c19-14-5-3-12(4-6-14)16-17(13-7-10-20-11-8-13)22-15-2-1-9-21-18(15)16/h1-11,22H
InChIKeyDPGNJQAIOXNWEY-UHFFFAOYSA-N
XLogP4.43
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.31
LogP ≤ 54.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(4-fluorophenyl)-2-pyridin-4-yl-1H-pyrrolo[3,2-b]pyridine?
The IUPAC name of 3-(4-fluorophenyl)-2-pyridin-4-yl-1H-pyrrolo[3,2-b]pyridine (CID 11833097) is 3-(4-fluorophenyl)-2-pyridin-4-yl-1H-pyrrolo[3,2-b]pyridine.
What is the SMILES notation for 3-(4-fluorophenyl)-2-pyridin-4-yl-1H-pyrrolo[3,2-b]pyridine?
The canonical SMILES for 3-(4-fluorophenyl)-2-pyridin-4-yl-1H-pyrrolo[3,2-b]pyridine is Fc1ccc(-c2c(-c3ccncc3)[nH]c3cccnc23)cc1.
What is the InChIKey of 3-(4-fluorophenyl)-2-pyridin-4-yl-1H-pyrrolo[3,2-b]pyridine?
The InChIKey is DPGNJQAIOXNWEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H12FN3/c19-14-5-3-12(4-6-14)16-17(13-7-10-20-11-8-13)22-15-2-1-9-21-18(15)16/h1-11,22H.
What are the key properties of 3-(4-fluorophenyl)-2-pyridin-4-yl-1H-pyrrolo[3,2-b]pyridine?
3-(4-fluorophenyl)-2-pyridin-4-yl-1H-pyrrolo[3,2-b]pyridine has a molecular weight of 289.31 g/mol, XLogP of 4.43, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-fluorophenyl)-2-pyridin-4-yl-1H-pyrrolo[3,2-b]pyridine is sourced from PubChem (CID 11833097), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).