3-(furan-2-ylmethyl)-1H-imidazo[4,5-b]pyridin-2-one

C11H9N3O2 — CID 3244221

IUPAC3-(furan-2-ylmethyl)-1H-imidazo[4,5-b]pyridin-2-one
SMILESO=c1[nH]c2cccnc2n1Cc1ccco1
InChIInChI=1S/C11H9N3O2/c15-11-13-9-4-1-5-12-10(9)14(11)7-8-3-2-6-16-8/h1-6H,7H2,(H,13,15)
InChIKeySVMZXZIVPDIBMR-UHFFFAOYSA-N
MW215.21 g/mol
LogP1.37
Rot. Bonds2

About 3-(furan-2-ylmethyl)-1H-imidazo[4,5-b]pyridin-2-one

3-(furan-2-ylmethyl)-1H-imidazo[4,5-b]pyridin-2-one (PubChem CID 3244221) has the molecular formula C11H9N3O2 and a molecular weight of 215.21 g/mol. Its IUPAC name is 3-(furan-2-ylmethyl)-1H-imidazo[4,5-b]pyridin-2-one.

Molecular Properties

Compound Name3-(furan-2-ylmethyl)-1H-imidazo[4,5-b]pyridin-2-one
PubChem CID3244221
Molecular FormulaC11H9N3O2
Molecular Weight215.21 g/mol
Exact Mass215.07
IUPAC Name3-(furan-2-ylmethyl)-1H-imidazo[4,5-b]pyridin-2-one
SMILESO=c1[nH]c2cccnc2n1Cc1ccco1
InChIInChI=1S/C11H9N3O2/c15-11-13-9-4-1-5-12-10(9)14(11)7-8-3-2-6-16-8/h1-6H,7H2,(H,13,15)
InChIKeySVMZXZIVPDIBMR-UHFFFAOYSA-N
XLogP1.37
TPSA63.82 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.21
LogP ≤ 51.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-(furan-2-ylmethyl)-1H-imidazo[4,5-b]pyridin-2-one?
The IUPAC name of 3-(furan-2-ylmethyl)-1H-imidazo[4,5-b]pyridin-2-one (CID 3244221) is 3-(furan-2-ylmethyl)-1H-imidazo[4,5-b]pyridin-2-one.
What is the SMILES notation for 3-(furan-2-ylmethyl)-1H-imidazo[4,5-b]pyridin-2-one?
The canonical SMILES for 3-(furan-2-ylmethyl)-1H-imidazo[4,5-b]pyridin-2-one is O=c1[nH]c2cccnc2n1Cc1ccco1.
What is the InChIKey of 3-(furan-2-ylmethyl)-1H-imidazo[4,5-b]pyridin-2-one?
The InChIKey is SVMZXZIVPDIBMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9N3O2/c15-11-13-9-4-1-5-12-10(9)14(11)7-8-3-2-6-16-8/h1-6H,7H2,(H,13,15).
What are the key properties of 3-(furan-2-ylmethyl)-1H-imidazo[4,5-b]pyridin-2-one?
3-(furan-2-ylmethyl)-1H-imidazo[4,5-b]pyridin-2-one has a molecular weight of 215.21 g/mol, XLogP of 1.37, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(furan-2-ylmethyl)-1H-imidazo[4,5-b]pyridin-2-one is sourced from PubChem (CID 3244221), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).