6-[2-(4-fluorophenyl)imidazo[4,5-b]pyridin-3-yl]-2,3-dihydro-1,3-benzoxazole

C19H13FN4O — CID 175719366

IUPAC6-[2-(4-fluorophenyl)imidazo[4,5-b]pyridin-3-yl]-2,3-dihydro-1,3-benzoxazole
SMILESFc1ccc(-c2nc3cccnc3n2-c2ccc3c(c2)OCN3)cc1
InChIInChI=1S/C19H13FN4O/c20-13-5-3-12(4-6-13)18-23-16-2-1-9-21-19(16)24(18)14-7-8-15-17(10-14)25-11-22-15/h1-10,22H,11H2
InChIKeyGZLZYDBJFDXHQX-UHFFFAOYSA-N
MW332.34 g/mol
LogP3.99
Rot. Bonds2

About 6-[2-(4-fluorophenyl)imidazo[4,5-b]pyridin-3-yl]-2,3-dihydro-1,3-benzoxazole

6-[2-(4-fluorophenyl)imidazo[4,5-b]pyridin-3-yl]-2,3-dihydro-1,3-benzoxazole (PubChem CID 175719366) has the molecular formula C19H13FN4O and a molecular weight of 332.34 g/mol. Its IUPAC name is 6-[2-(4-fluorophenyl)imidazo[4,5-b]pyridin-3-yl]-2,3-dihydro-1,3-benzoxazole.

Molecular Properties

Compound Name6-[2-(4-fluorophenyl)imidazo[4,5-b]pyridin-3-yl]-2,3-dihydro-1,3-benzoxazole
PubChem CID175719366
Molecular FormulaC19H13FN4O
Molecular Weight332.34 g/mol
Exact Mass332.11
IUPAC Name6-[2-(4-fluorophenyl)imidazo[4,5-b]pyridin-3-yl]-2,3-dihydro-1,3-benzoxazole
SMILESFc1ccc(-c2nc3cccnc3n2-c2ccc3c(c2)OCN3)cc1
InChIInChI=1S/C19H13FN4O/c20-13-5-3-12(4-6-13)18-23-16-2-1-9-21-19(16)24(18)14-7-8-15-17(10-14)25-11-22-15/h1-10,22H,11H2
InChIKeyGZLZYDBJFDXHQX-UHFFFAOYSA-N
XLogP3.99
TPSA51.97 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.34
LogP ≤ 53.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-[2-(4-fluorophenyl)imidazo[4,5-b]pyridin-3-yl]-2,3-dihydro-1,3-benzoxazole?
The IUPAC name of 6-[2-(4-fluorophenyl)imidazo[4,5-b]pyridin-3-yl]-2,3-dihydro-1,3-benzoxazole (CID 175719366) is 6-[2-(4-fluorophenyl)imidazo[4,5-b]pyridin-3-yl]-2,3-dihydro-1,3-benzoxazole.
What is the SMILES notation for 6-[2-(4-fluorophenyl)imidazo[4,5-b]pyridin-3-yl]-2,3-dihydro-1,3-benzoxazole?
The canonical SMILES for 6-[2-(4-fluorophenyl)imidazo[4,5-b]pyridin-3-yl]-2,3-dihydro-1,3-benzoxazole is Fc1ccc(-c2nc3cccnc3n2-c2ccc3c(c2)OCN3)cc1.
What is the InChIKey of 6-[2-(4-fluorophenyl)imidazo[4,5-b]pyridin-3-yl]-2,3-dihydro-1,3-benzoxazole?
The InChIKey is GZLZYDBJFDXHQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H13FN4O/c20-13-5-3-12(4-6-13)18-23-16-2-1-9-21-19(16)24(18)14-7-8-15-17(10-14)25-11-22-15/h1-10,22H,11H2.
What are the key properties of 6-[2-(4-fluorophenyl)imidazo[4,5-b]pyridin-3-yl]-2,3-dihydro-1,3-benzoxazole?
6-[2-(4-fluorophenyl)imidazo[4,5-b]pyridin-3-yl]-2,3-dihydro-1,3-benzoxazole has a molecular weight of 332.34 g/mol, XLogP of 3.99, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[2-(4-fluorophenyl)imidazo[4,5-b]pyridin-3-yl]-2,3-dihydro-1,3-benzoxazole is sourced from PubChem (CID 175719366), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).