2-[4-[7-(furan-2-yl)imidazo[1,2-a]pyridin-3-yl]phenyl]acetonitrile

C19H13N3O — CID 118733893

IUPAC2-[4-[7-(furan-2-yl)imidazo[1,2-a]pyridin-3-yl]phenyl]acetonitrile
SMILESN#CCc1ccc(-c2cnc3cc(-c4ccco4)ccn23)cc1
InChIInChI=1S/C19H13N3O/c20-9-7-14-3-5-15(6-4-14)17-13-21-19-12-16(8-10-22(17)19)18-2-1-11-23-18/h1-6,8,10-13H,7H2
InChIKeyHWMGPHOVSTXAIK-UHFFFAOYSA-N
MW299.33 g/mol
LogP4.33
Rot. Bonds3

About 2-[4-[7-(furan-2-yl)imidazo[1,2-a]pyridin-3-yl]phenyl]acetonitrile

2-[4-[7-(furan-2-yl)imidazo[1,2-a]pyridin-3-yl]phenyl]acetonitrile (PubChem CID 118733893) has the molecular formula C19H13N3O and a molecular weight of 299.33 g/mol. Its IUPAC name is 2-[4-[7-(furan-2-yl)imidazo[1,2-a]pyridin-3-yl]phenyl]acetonitrile.

Molecular Properties

Compound Name2-[4-[7-(furan-2-yl)imidazo[1,2-a]pyridin-3-yl]phenyl]acetonitrile
PubChem CID118733893
Molecular FormulaC19H13N3O
Molecular Weight299.33 g/mol
Exact Mass299.11
IUPAC Name2-[4-[7-(furan-2-yl)imidazo[1,2-a]pyridin-3-yl]phenyl]acetonitrile
SMILESN#CCc1ccc(-c2cnc3cc(-c4ccco4)ccn23)cc1
InChIInChI=1S/C19H13N3O/c20-9-7-14-3-5-15(6-4-14)17-13-21-19-12-16(8-10-22(17)19)18-2-1-11-23-18/h1-6,8,10-13H,7H2
InChIKeyHWMGPHOVSTXAIK-UHFFFAOYSA-N
XLogP4.33
TPSA54.23 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.33
LogP ≤ 54.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[4-[7-(furan-2-yl)imidazo[1,2-a]pyridin-3-yl]phenyl]acetonitrile?
The IUPAC name of 2-[4-[7-(furan-2-yl)imidazo[1,2-a]pyridin-3-yl]phenyl]acetonitrile (CID 118733893) is 2-[4-[7-(furan-2-yl)imidazo[1,2-a]pyridin-3-yl]phenyl]acetonitrile.
What is the SMILES notation for 2-[4-[7-(furan-2-yl)imidazo[1,2-a]pyridin-3-yl]phenyl]acetonitrile?
The canonical SMILES for 2-[4-[7-(furan-2-yl)imidazo[1,2-a]pyridin-3-yl]phenyl]acetonitrile is N#CCc1ccc(-c2cnc3cc(-c4ccco4)ccn23)cc1.
What is the InChIKey of 2-[4-[7-(furan-2-yl)imidazo[1,2-a]pyridin-3-yl]phenyl]acetonitrile?
The InChIKey is HWMGPHOVSTXAIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H13N3O/c20-9-7-14-3-5-15(6-4-14)17-13-21-19-12-16(8-10-22(17)19)18-2-1-11-23-18/h1-6,8,10-13H,7H2.
What are the key properties of 2-[4-[7-(furan-2-yl)imidazo[1,2-a]pyridin-3-yl]phenyl]acetonitrile?
2-[4-[7-(furan-2-yl)imidazo[1,2-a]pyridin-3-yl]phenyl]acetonitrile has a molecular weight of 299.33 g/mol, XLogP of 4.33, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[7-(furan-2-yl)imidazo[1,2-a]pyridin-3-yl]phenyl]acetonitrile is sourced from PubChem (CID 118733893), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).