5-(furan-2-yl)-6-pyrimidin-4-yl-1,3-dihydroimidazo[4,5-b]pyridin-2-one

C14H9N5O2 — CID 11953248

IUPAC5-(furan-2-yl)-6-pyrimidin-4-yl-1,3-dihydroimidazo[4,5-b]pyridin-2-one
SMILESO=c1[nH]c2cc(-c3ccncn3)c(-c3ccco3)nc2[nH]1
InChIInChI=1S/C14H9N5O2/c20-14-17-10-6-8(9-3-4-15-7-16-9)12(18-13(10)19-14)11-2-1-5-21-11/h1-7H,(H2,17,18,19,20)
InChIKeyMKVQVZUHJKLKRR-UHFFFAOYSA-N
MW279.26 g/mol
LogP1.97
Rot. Bonds2

About 5-(furan-2-yl)-6-pyrimidin-4-yl-1,3-dihydroimidazo[4,5-b]pyridin-2-one

5-(furan-2-yl)-6-pyrimidin-4-yl-1,3-dihydroimidazo[4,5-b]pyridin-2-one (PubChem CID 11953248) has the molecular formula C14H9N5O2 and a molecular weight of 279.26 g/mol. Its IUPAC name is 5-(furan-2-yl)-6-pyrimidin-4-yl-1,3-dihydroimidazo[4,5-b]pyridin-2-one.

Molecular Properties

Compound Name5-(furan-2-yl)-6-pyrimidin-4-yl-1,3-dihydroimidazo[4,5-b]pyridin-2-one
PubChem CID11953248
Molecular FormulaC14H9N5O2
Molecular Weight279.26 g/mol
Exact Mass279.08
IUPAC Name5-(furan-2-yl)-6-pyrimidin-4-yl-1,3-dihydroimidazo[4,5-b]pyridin-2-one
SMILESO=c1[nH]c2cc(-c3ccncn3)c(-c3ccco3)nc2[nH]1
InChIInChI=1S/C14H9N5O2/c20-14-17-10-6-8(9-3-4-15-7-16-9)12(18-13(10)19-14)11-2-1-5-21-11/h1-7H,(H2,17,18,19,20)
InChIKeyMKVQVZUHJKLKRR-UHFFFAOYSA-N
XLogP1.97
TPSA100.46 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.26
LogP ≤ 51.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-(furan-2-yl)-6-pyrimidin-4-yl-1,3-dihydroimidazo[4,5-b]pyridin-2-one?
The IUPAC name of 5-(furan-2-yl)-6-pyrimidin-4-yl-1,3-dihydroimidazo[4,5-b]pyridin-2-one (CID 11953248) is 5-(furan-2-yl)-6-pyrimidin-4-yl-1,3-dihydroimidazo[4,5-b]pyridin-2-one.
What is the SMILES notation for 5-(furan-2-yl)-6-pyrimidin-4-yl-1,3-dihydroimidazo[4,5-b]pyridin-2-one?
The canonical SMILES for 5-(furan-2-yl)-6-pyrimidin-4-yl-1,3-dihydroimidazo[4,5-b]pyridin-2-one is O=c1[nH]c2cc(-c3ccncn3)c(-c3ccco3)nc2[nH]1.
What is the InChIKey of 5-(furan-2-yl)-6-pyrimidin-4-yl-1,3-dihydroimidazo[4,5-b]pyridin-2-one?
The InChIKey is MKVQVZUHJKLKRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H9N5O2/c20-14-17-10-6-8(9-3-4-15-7-16-9)12(18-13(10)19-14)11-2-1-5-21-11/h1-7H,(H2,17,18,19,20).
What are the key properties of 5-(furan-2-yl)-6-pyrimidin-4-yl-1,3-dihydroimidazo[4,5-b]pyridin-2-one?
5-(furan-2-yl)-6-pyrimidin-4-yl-1,3-dihydroimidazo[4,5-b]pyridin-2-one has a molecular weight of 279.26 g/mol, XLogP of 1.97, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(furan-2-yl)-6-pyrimidin-4-yl-1,3-dihydroimidazo[4,5-b]pyridin-2-one is sourced from PubChem (CID 11953248), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).