6-(furan-2-yl)-5-pyrimidin-4-yl-1H-pyrrolo[2,3-b]pyridine

C15H10N4O — CID 11952665

IUPAC6-(furan-2-yl)-5-pyrimidin-4-yl-1H-pyrrolo[2,3-b]pyridine
SMILESc1coc(-c2nc3[nH]ccc3cc2-c2ccncn2)c1
InChIInChI=1S/C15H10N4O/c1-2-13(20-7-1)14-11(12-4-5-16-9-18-12)8-10-3-6-17-15(10)19-14/h1-9H,(H,17,19)
InChIKeySDUHCRWJXFZMQH-UHFFFAOYSA-N
MW262.27 g/mol
LogP3.28
Rot. Bonds2

About 6-(furan-2-yl)-5-pyrimidin-4-yl-1H-pyrrolo[2,3-b]pyridine

6-(furan-2-yl)-5-pyrimidin-4-yl-1H-pyrrolo[2,3-b]pyridine (PubChem CID 11952665) has the molecular formula C15H10N4O and a molecular weight of 262.27 g/mol. Its IUPAC name is 6-(furan-2-yl)-5-pyrimidin-4-yl-1H-pyrrolo[2,3-b]pyridine.

Molecular Properties

Compound Name6-(furan-2-yl)-5-pyrimidin-4-yl-1H-pyrrolo[2,3-b]pyridine
PubChem CID11952665
Molecular FormulaC15H10N4O
Molecular Weight262.27 g/mol
Exact Mass262.09
IUPAC Name6-(furan-2-yl)-5-pyrimidin-4-yl-1H-pyrrolo[2,3-b]pyridine
SMILESc1coc(-c2nc3[nH]ccc3cc2-c2ccncn2)c1
InChIInChI=1S/C15H10N4O/c1-2-13(20-7-1)14-11(12-4-5-16-9-18-12)8-10-3-6-17-15(10)19-14/h1-9H,(H,17,19)
InChIKeySDUHCRWJXFZMQH-UHFFFAOYSA-N
XLogP3.28
TPSA67.60 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.27
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-(furan-2-yl)-5-pyrimidin-4-yl-1H-pyrrolo[2,3-b]pyridine?
The IUPAC name of 6-(furan-2-yl)-5-pyrimidin-4-yl-1H-pyrrolo[2,3-b]pyridine (CID 11952665) is 6-(furan-2-yl)-5-pyrimidin-4-yl-1H-pyrrolo[2,3-b]pyridine.
What is the SMILES notation for 6-(furan-2-yl)-5-pyrimidin-4-yl-1H-pyrrolo[2,3-b]pyridine?
The canonical SMILES for 6-(furan-2-yl)-5-pyrimidin-4-yl-1H-pyrrolo[2,3-b]pyridine is c1coc(-c2nc3[nH]ccc3cc2-c2ccncn2)c1.
What is the InChIKey of 6-(furan-2-yl)-5-pyrimidin-4-yl-1H-pyrrolo[2,3-b]pyridine?
The InChIKey is SDUHCRWJXFZMQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10N4O/c1-2-13(20-7-1)14-11(12-4-5-16-9-18-12)8-10-3-6-17-15(10)19-14/h1-9H,(H,17,19).
What are the key properties of 6-(furan-2-yl)-5-pyrimidin-4-yl-1H-pyrrolo[2,3-b]pyridine?
6-(furan-2-yl)-5-pyrimidin-4-yl-1H-pyrrolo[2,3-b]pyridine has a molecular weight of 262.27 g/mol, XLogP of 3.28, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(furan-2-yl)-5-pyrimidin-4-yl-1H-pyrrolo[2,3-b]pyridine is sourced from PubChem (CID 11952665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).