3-(4-fluorophenyl)-2-pyridin-3-yl-1H-pyrrolo[3,2-b]pyridine-5-carbonitrile

C19H11FN4 — CID 44573123

IUPAC3-(4-fluorophenyl)-2-pyridin-3-yl-1H-pyrrolo[3,2-b]pyridine-5-carbonitrile
SMILESN#Cc1ccc2[nH]c(-c3cccnc3)c(-c3ccc(F)cc3)c2n1
InChIInChI=1S/C19H11FN4/c20-14-5-3-12(4-6-14)17-18(13-2-1-9-22-11-13)24-16-8-7-15(10-21)23-19(16)17/h1-9,11,24H
InChIKeyLQBWYHGAMQUGEW-UHFFFAOYSA-N
MW314.32 g/mol
LogP4.30
Rot. Bonds2

About 3-(4-fluorophenyl)-2-pyridin-3-yl-1H-pyrrolo[3,2-b]pyridine-5-carbonitrile

3-(4-fluorophenyl)-2-pyridin-3-yl-1H-pyrrolo[3,2-b]pyridine-5-carbonitrile (PubChem CID 44573123) has the molecular formula C19H11FN4 and a molecular weight of 314.32 g/mol. Its IUPAC name is 3-(4-fluorophenyl)-2-pyridin-3-yl-1H-pyrrolo[3,2-b]pyridine-5-carbonitrile.

Molecular Properties

Compound Name3-(4-fluorophenyl)-2-pyridin-3-yl-1H-pyrrolo[3,2-b]pyridine-5-carbonitrile
PubChem CID44573123
Molecular FormulaC19H11FN4
Molecular Weight314.32 g/mol
Exact Mass314.10
IUPAC Name3-(4-fluorophenyl)-2-pyridin-3-yl-1H-pyrrolo[3,2-b]pyridine-5-carbonitrile
SMILESN#Cc1ccc2[nH]c(-c3cccnc3)c(-c3ccc(F)cc3)c2n1
InChIInChI=1S/C19H11FN4/c20-14-5-3-12(4-6-14)17-18(13-2-1-9-22-11-13)24-16-8-7-15(10-21)23-19(16)17/h1-9,11,24H
InChIKeyLQBWYHGAMQUGEW-UHFFFAOYSA-N
XLogP4.30
TPSA65.36 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.32
LogP ≤ 54.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3-(4-fluorophenyl)-2-pyridin-3-yl-1H-pyrrolo[3,2-b]pyridine-5-carbonitrile with MolForge

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

Launch Full Analysis

Related Compounds

3-(4-fluorophenyl)-2-phenyl-1H-pyrrolo[3,2-b]pyridine-5-carbonitrile
CID 44573241
3-(3,5-dichlorophenyl)-2-pyridin-4-yl-1H-pyrrolo[3,2-b]pyridine-5-carbonitrile
CID 44573173
2-[2-(benzylamino)-4-pyridinyl]-3-(3-chloro-4-fluorophenyl)-1H-pyrrolo[3,2-b]pyridine-5-carbonitrile
CID 44573178
4-fluoro-2-pyridin-3-ylbenzonitrile
CID 46315558
5-chloro-2-pyridin-3-yl-1H-indole-3-carbonitrile
CID 58215807
3-[4-(4-fluorophenoxy)phenyl]pyridine
CID 91298278
4,7-bis(4-fluorophenyl)-6-pyridin-3-yl-[1,2,5]oxadiazolo[3,4-c]pyridine
CID 132537703
5,10-bis(4-fluorophenyl)benzo[g]quinoline
CID 59183532
3-fluoro-5-pyridin-3-ylbenzonitrile
CID 46315568
3-[2-(4-fluorophenyl)-5-(methylsulfinylmethyl)-1H-imidazol-4-yl]pyridine
CID 59384918
4-[10-[4-(4-phenyl-6-pyridin-3-yl-1,3,5-triazin-2-yl)phenyl]phenanthren-9-yl]benzonitrile
CID 171588857
2-(2-chloro-4-pyridinyl)-3-(4-fluorophenyl)-5-isocyano-1H-pyrrolo[3,2-b]pyridine
CID 58407677

Frequently Asked Questions

What is the IUPAC name of 3-(4-fluorophenyl)-2-pyridin-3-yl-1H-pyrrolo[3,2-b]pyridine-5-carbonitrile?
The IUPAC name of 3-(4-fluorophenyl)-2-pyridin-3-yl-1H-pyrrolo[3,2-b]pyridine-5-carbonitrile (CID 44573123) is 3-(4-fluorophenyl)-2-pyridin-3-yl-1H-pyrrolo[3,2-b]pyridine-5-carbonitrile.
What is the SMILES notation for 3-(4-fluorophenyl)-2-pyridin-3-yl-1H-pyrrolo[3,2-b]pyridine-5-carbonitrile?
The canonical SMILES for 3-(4-fluorophenyl)-2-pyridin-3-yl-1H-pyrrolo[3,2-b]pyridine-5-carbonitrile is N#Cc1ccc2[nH]c(-c3cccnc3)c(-c3ccc(F)cc3)c2n1.
What is the InChIKey of 3-(4-fluorophenyl)-2-pyridin-3-yl-1H-pyrrolo[3,2-b]pyridine-5-carbonitrile?
The InChIKey is LQBWYHGAMQUGEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H11FN4/c20-14-5-3-12(4-6-14)17-18(13-2-1-9-22-11-13)24-16-8-7-15(10-21)23-19(16)17/h1-9,11,24H.
What are the key properties of 3-(4-fluorophenyl)-2-pyridin-3-yl-1H-pyrrolo[3,2-b]pyridine-5-carbonitrile?
3-(4-fluorophenyl)-2-pyridin-3-yl-1H-pyrrolo[3,2-b]pyridine-5-carbonitrile has a molecular weight of 314.32 g/mol, XLogP of 4.30, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-fluorophenyl)-2-pyridin-3-yl-1H-pyrrolo[3,2-b]pyridine-5-carbonitrile is sourced from PubChem (CID 44573123), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).