4-(4-fluorophenyl)-5-(imidazo[1,2-a]pyridin-6-ylmethoxy)pyridine-2-carbonitrile

C20H13FN4O — CID 122539799

IUPAC4-(4-fluorophenyl)-5-(imidazo[1,2-a]pyridin-6-ylmethoxy)pyridine-2-carbonitrile
SMILESN#Cc1cc(-c2ccc(F)cc2)c(OCc2ccc3nccn3c2)cn1
InChIInChI=1S/C20H13FN4O/c21-16-4-2-15(3-5-16)18-9-17(10-22)24-11-19(18)26-13-14-1-6-20-23-7-8-25(20)12-14/h1-9,11-12H,13H2
InChIKeyIRMMJEXTIQVKGD-UHFFFAOYSA-N
MW344.35 g/mol
LogP3.99
Rot. Bonds4

About 4-(4-fluorophenyl)-5-(imidazo[1,2-a]pyridin-6-ylmethoxy)pyridine-2-carbonitrile

4-(4-fluorophenyl)-5-(imidazo[1,2-a]pyridin-6-ylmethoxy)pyridine-2-carbonitrile (PubChem CID 122539799) has the molecular formula C20H13FN4O and a molecular weight of 344.35 g/mol. Its IUPAC name is 4-(4-fluorophenyl)-5-(imidazo[1,2-a]pyridin-6-ylmethoxy)pyridine-2-carbonitrile.

Molecular Properties

Compound Name4-(4-fluorophenyl)-5-(imidazo[1,2-a]pyridin-6-ylmethoxy)pyridine-2-carbonitrile
PubChem CID122539799
Molecular FormulaC20H13FN4O
Molecular Weight344.35 g/mol
Exact Mass344.11
IUPAC Name4-(4-fluorophenyl)-5-(imidazo[1,2-a]pyridin-6-ylmethoxy)pyridine-2-carbonitrile
SMILESN#Cc1cc(-c2ccc(F)cc2)c(OCc2ccc3nccn3c2)cn1
InChIInChI=1S/C20H13FN4O/c21-16-4-2-15(3-5-16)18-9-17(10-22)24-11-19(18)26-13-14-1-6-20-23-7-8-25(20)12-14/h1-9,11-12H,13H2
InChIKeyIRMMJEXTIQVKGD-UHFFFAOYSA-N
XLogP3.99
TPSA63.21 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.35
LogP ≤ 53.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-(4-fluorophenyl)-5-(imidazo[1,2-a]pyridin-6-ylmethoxy)pyridine-2-carbonitrile?
The IUPAC name of 4-(4-fluorophenyl)-5-(imidazo[1,2-a]pyridin-6-ylmethoxy)pyridine-2-carbonitrile (CID 122539799) is 4-(4-fluorophenyl)-5-(imidazo[1,2-a]pyridin-6-ylmethoxy)pyridine-2-carbonitrile.
What is the SMILES notation for 4-(4-fluorophenyl)-5-(imidazo[1,2-a]pyridin-6-ylmethoxy)pyridine-2-carbonitrile?
The canonical SMILES for 4-(4-fluorophenyl)-5-(imidazo[1,2-a]pyridin-6-ylmethoxy)pyridine-2-carbonitrile is N#Cc1cc(-c2ccc(F)cc2)c(OCc2ccc3nccn3c2)cn1.
What is the InChIKey of 4-(4-fluorophenyl)-5-(imidazo[1,2-a]pyridin-6-ylmethoxy)pyridine-2-carbonitrile?
The InChIKey is IRMMJEXTIQVKGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H13FN4O/c21-16-4-2-15(3-5-16)18-9-17(10-22)24-11-19(18)26-13-14-1-6-20-23-7-8-25(20)12-14/h1-9,11-12H,13H2.
What are the key properties of 4-(4-fluorophenyl)-5-(imidazo[1,2-a]pyridin-6-ylmethoxy)pyridine-2-carbonitrile?
4-(4-fluorophenyl)-5-(imidazo[1,2-a]pyridin-6-ylmethoxy)pyridine-2-carbonitrile has a molecular weight of 344.35 g/mol, XLogP of 3.99, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-fluorophenyl)-5-(imidazo[1,2-a]pyridin-6-ylmethoxy)pyridine-2-carbonitrile is sourced from PubChem (CID 122539799), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).