(7R)-7-(4-fluorophenyl)-3-pyridin-3-yl-6,7-dihydro-4H-imidazo[4,5-b]pyridin-5-one

C17H13FN4O — CID 51973940

IUPAC(7R)-7-(4-fluorophenyl)-3-pyridin-3-yl-6,7-dihydro-4H-imidazo[4,5-b]pyridin-5-one
SMILESO=C1C[C@H](c2ccc(F)cc2)c2ncn(-c3cccnc3)c2N1
InChIInChI=1S/C17H13FN4O/c18-12-5-3-11(4-6-12)14-8-15(23)21-17-16(14)20-10-22(17)13-2-1-7-19-9-13/h1-7,9-10,14H,8H2,(H,21,23)/t14-/m1/s1
InChIKeyZRJUHJYZPIHPNO-CQSZACIVSA-N
MW308.32 g/mol
LogP2.88
Rot. Bonds2

About (7R)-7-(4-fluorophenyl)-3-pyridin-3-yl-6,7-dihydro-4H-imidazo[4,5-b]pyridin-5-one

(7R)-7-(4-fluorophenyl)-3-pyridin-3-yl-6,7-dihydro-4H-imidazo[4,5-b]pyridin-5-one (PubChem CID 51973940) has the molecular formula C17H13FN4O and a molecular weight of 308.32 g/mol. Its IUPAC name is (7R)-7-(4-fluorophenyl)-3-pyridin-3-yl-6,7-dihydro-4H-imidazo[4,5-b]pyridin-5-one.

Molecular Properties

Compound Name(7R)-7-(4-fluorophenyl)-3-pyridin-3-yl-6,7-dihydro-4H-imidazo[4,5-b]pyridin-5-one
PubChem CID51973940
Molecular FormulaC17H13FN4O
Molecular Weight308.32 g/mol
Exact Mass308.11
IUPAC Name(7R)-7-(4-fluorophenyl)-3-pyridin-3-yl-6,7-dihydro-4H-imidazo[4,5-b]pyridin-5-one
SMILESO=C1C[C@H](c2ccc(F)cc2)c2ncn(-c3cccnc3)c2N1
InChIInChI=1S/C17H13FN4O/c18-12-5-3-11(4-6-12)14-8-15(23)21-17-16(14)20-10-22(17)13-2-1-7-19-9-13/h1-7,9-10,14H,8H2,(H,21,23)/t14-/m1/s1
InChIKeyZRJUHJYZPIHPNO-CQSZACIVSA-N
XLogP2.88
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.32
LogP ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (7R)-7-(4-fluorophenyl)-3-pyridin-3-yl-6,7-dihydro-4H-imidazo[4,5-b]pyridin-5-one?
The IUPAC name of (7R)-7-(4-fluorophenyl)-3-pyridin-3-yl-6,7-dihydro-4H-imidazo[4,5-b]pyridin-5-one (CID 51973940) is (7R)-7-(4-fluorophenyl)-3-pyridin-3-yl-6,7-dihydro-4H-imidazo[4,5-b]pyridin-5-one.
What is the SMILES notation for (7R)-7-(4-fluorophenyl)-3-pyridin-3-yl-6,7-dihydro-4H-imidazo[4,5-b]pyridin-5-one?
The canonical SMILES for (7R)-7-(4-fluorophenyl)-3-pyridin-3-yl-6,7-dihydro-4H-imidazo[4,5-b]pyridin-5-one is O=C1C[C@H](c2ccc(F)cc2)c2ncn(-c3cccnc3)c2N1.
What is the InChIKey of (7R)-7-(4-fluorophenyl)-3-pyridin-3-yl-6,7-dihydro-4H-imidazo[4,5-b]pyridin-5-one?
The InChIKey is ZRJUHJYZPIHPNO-CQSZACIVSA-N. The full InChI is InChI=1S/C17H13FN4O/c18-12-5-3-11(4-6-12)14-8-15(23)21-17-16(14)20-10-22(17)13-2-1-7-19-9-13/h1-7,9-10,14H,8H2,(H,21,23)/t14-/m1/s1.
What are the key properties of (7R)-7-(4-fluorophenyl)-3-pyridin-3-yl-6,7-dihydro-4H-imidazo[4,5-b]pyridin-5-one?
(7R)-7-(4-fluorophenyl)-3-pyridin-3-yl-6,7-dihydro-4H-imidazo[4,5-b]pyridin-5-one has a molecular weight of 308.32 g/mol, XLogP of 2.88, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (7R)-7-(4-fluorophenyl)-3-pyridin-3-yl-6,7-dihydro-4H-imidazo[4,5-b]pyridin-5-one is sourced from PubChem (CID 51973940), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).