3-(4-fluorophenyl)-1-methyl-2-pyridin-4-ylpyrrolo[3,2-b]pyridine

C19H14FN3 — CID 11822822

IUPAC3-(4-fluorophenyl)-1-methyl-2-pyridin-4-ylpyrrolo[3,2-b]pyridine
SMILESCn1c(-c2ccncc2)c(-c2ccc(F)cc2)c2ncccc21
InChIInChI=1S/C19H14FN3/c1-23-16-3-2-10-22-18(16)17(13-4-6-15(20)7-5-13)19(23)14-8-11-21-12-9-14/h2-12H,1H3
InChIKeySVHIOPOOPNXCLH-UHFFFAOYSA-N
MW303.34 g/mol
LogP4.44
Rot. Bonds2

About 3-(4-fluorophenyl)-1-methyl-2-pyridin-4-ylpyrrolo[3,2-b]pyridine

3-(4-fluorophenyl)-1-methyl-2-pyridin-4-ylpyrrolo[3,2-b]pyridine (PubChem CID 11822822) has the molecular formula C19H14FN3 and a molecular weight of 303.34 g/mol. Its IUPAC name is 3-(4-fluorophenyl)-1-methyl-2-pyridin-4-ylpyrrolo[3,2-b]pyridine.

Molecular Properties

Compound Name3-(4-fluorophenyl)-1-methyl-2-pyridin-4-ylpyrrolo[3,2-b]pyridine
PubChem CID11822822
Molecular FormulaC19H14FN3
Molecular Weight303.34 g/mol
Exact Mass303.12
IUPAC Name3-(4-fluorophenyl)-1-methyl-2-pyridin-4-ylpyrrolo[3,2-b]pyridine
SMILESCn1c(-c2ccncc2)c(-c2ccc(F)cc2)c2ncccc21
InChIInChI=1S/C19H14FN3/c1-23-16-3-2-10-22-18(16)17(13-4-6-15(20)7-5-13)19(23)14-8-11-21-12-9-14/h2-12H,1H3
InChIKeySVHIOPOOPNXCLH-UHFFFAOYSA-N
XLogP4.44
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.34
LogP ≤ 54.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-(4-fluorophenyl)-1-methyl-2-pyridin-4-ylpyrrolo[3,2-b]pyridine?
The IUPAC name of 3-(4-fluorophenyl)-1-methyl-2-pyridin-4-ylpyrrolo[3,2-b]pyridine (CID 11822822) is 3-(4-fluorophenyl)-1-methyl-2-pyridin-4-ylpyrrolo[3,2-b]pyridine.
What is the SMILES notation for 3-(4-fluorophenyl)-1-methyl-2-pyridin-4-ylpyrrolo[3,2-b]pyridine?
The canonical SMILES for 3-(4-fluorophenyl)-1-methyl-2-pyridin-4-ylpyrrolo[3,2-b]pyridine is Cn1c(-c2ccncc2)c(-c2ccc(F)cc2)c2ncccc21.
What is the InChIKey of 3-(4-fluorophenyl)-1-methyl-2-pyridin-4-ylpyrrolo[3,2-b]pyridine?
The InChIKey is SVHIOPOOPNXCLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14FN3/c1-23-16-3-2-10-22-18(16)17(13-4-6-15(20)7-5-13)19(23)14-8-11-21-12-9-14/h2-12H,1H3.
What are the key properties of 3-(4-fluorophenyl)-1-methyl-2-pyridin-4-ylpyrrolo[3,2-b]pyridine?
3-(4-fluorophenyl)-1-methyl-2-pyridin-4-ylpyrrolo[3,2-b]pyridine has a molecular weight of 303.34 g/mol, XLogP of 4.44, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-fluorophenyl)-1-methyl-2-pyridin-4-ylpyrrolo[3,2-b]pyridine is sourced from PubChem (CID 11822822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).