5-(furan-2-yl)-6-pyrimidin-4-yl-1H-imidazo[4,5-b]pyridine

C14H9N5O — CID 11952504

IUPAC5-(furan-2-yl)-6-pyrimidin-4-yl-1H-imidazo[4,5-b]pyridine
SMILESc1coc(-c2nc3nc[nH]c3cc2-c2ccncn2)c1
InChIInChI=1S/C14H9N5O/c1-2-12(20-5-1)13-9(10-3-4-15-7-16-10)6-11-14(19-13)18-8-17-11/h1-8H,(H,17,18,19)
InChIKeyNDRMSISLKTZBKD-UHFFFAOYSA-N
MW263.26 g/mol
LogP2.67
Rot. Bonds2

About 5-(furan-2-yl)-6-pyrimidin-4-yl-1H-imidazo[4,5-b]pyridine

5-(furan-2-yl)-6-pyrimidin-4-yl-1H-imidazo[4,5-b]pyridine (PubChem CID 11952504) has the molecular formula C14H9N5O and a molecular weight of 263.26 g/mol. Its IUPAC name is 5-(furan-2-yl)-6-pyrimidin-4-yl-1H-imidazo[4,5-b]pyridine.

Molecular Properties

Compound Name5-(furan-2-yl)-6-pyrimidin-4-yl-1H-imidazo[4,5-b]pyridine
PubChem CID11952504
Molecular FormulaC14H9N5O
Molecular Weight263.26 g/mol
Exact Mass263.08
IUPAC Name5-(furan-2-yl)-6-pyrimidin-4-yl-1H-imidazo[4,5-b]pyridine
SMILESc1coc(-c2nc3nc[nH]c3cc2-c2ccncn2)c1
InChIInChI=1S/C14H9N5O/c1-2-12(20-5-1)13-9(10-3-4-15-7-16-10)6-11-14(19-13)18-8-17-11/h1-8H,(H,17,18,19)
InChIKeyNDRMSISLKTZBKD-UHFFFAOYSA-N
XLogP2.67
TPSA80.49 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.26
LogP ≤ 52.67
H-Bond Donors ≤ 51
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-1H-imidazo[4,5-b]pyridine?
The IUPAC name of 5-(furan-2-yl)-6-pyrimidin-4-yl-1H-imidazo[4,5-b]pyridine (CID 11952504) is 5-(furan-2-yl)-6-pyrimidin-4-yl-1H-imidazo[4,5-b]pyridine.
What is the SMILES notation for 5-(furan-2-yl)-6-pyrimidin-4-yl-1H-imidazo[4,5-b]pyridine?
The canonical SMILES for 5-(furan-2-yl)-6-pyrimidin-4-yl-1H-imidazo[4,5-b]pyridine is c1coc(-c2nc3nc[nH]c3cc2-c2ccncn2)c1.
What is the InChIKey of 5-(furan-2-yl)-6-pyrimidin-4-yl-1H-imidazo[4,5-b]pyridine?
The InChIKey is NDRMSISLKTZBKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H9N5O/c1-2-12(20-5-1)13-9(10-3-4-15-7-16-10)6-11-14(19-13)18-8-17-11/h1-8H,(H,17,18,19).
What are the key properties of 5-(furan-2-yl)-6-pyrimidin-4-yl-1H-imidazo[4,5-b]pyridine?
5-(furan-2-yl)-6-pyrimidin-4-yl-1H-imidazo[4,5-b]pyridine has a molecular weight of 263.26 g/mol, XLogP of 2.67, 2 rotatable bonds, 1 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-1H-imidazo[4,5-b]pyridine is sourced from PubChem (CID 11952504), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).