1-(2-chlorophenyl)-N-[2-(furan-2-yl)imidazo[1,2-a]pyridin-3-yl]methanimine

C18H12ClN3O — CID 682392

IUPAC1-(2-chlorophenyl)-N-[2-(furan-2-yl)imidazo[1,2-a]pyridin-3-yl]methanimine
SMILESClc1ccccc1C=Nc1c(-c2ccco2)nc2ccccn12
InChIInChI=1S/C18H12ClN3O/c19-14-7-2-1-6-13(14)12-20-18-17(15-8-5-11-23-15)21-16-9-3-4-10-22(16)18/h1-12H
InChIKeyNPGDBBGKJFIMEJ-UHFFFAOYSA-N
MW321.77 g/mol
LogP5.00
Rot. Bonds3

About 1-(2-chlorophenyl)-N-[2-(furan-2-yl)imidazo[1,2-a]pyridin-3-yl]methanimine

1-(2-chlorophenyl)-N-[2-(furan-2-yl)imidazo[1,2-a]pyridin-3-yl]methanimine (PubChem CID 682392) has the molecular formula C18H12ClN3O and a molecular weight of 321.77 g/mol. Its IUPAC name is 1-(2-chlorophenyl)-N-[2-(furan-2-yl)imidazo[1,2-a]pyridin-3-yl]methanimine.

Molecular Properties

Compound Name1-(2-chlorophenyl)-N-[2-(furan-2-yl)imidazo[1,2-a]pyridin-3-yl]methanimine
PubChem CID682392
Molecular FormulaC18H12ClN3O
Molecular Weight321.77 g/mol
Exact Mass321.07
IUPAC Name1-(2-chlorophenyl)-N-[2-(furan-2-yl)imidazo[1,2-a]pyridin-3-yl]methanimine
SMILESClc1ccccc1C=Nc1c(-c2ccco2)nc2ccccn12
InChIInChI=1S/C18H12ClN3O/c19-14-7-2-1-6-13(14)12-20-18-17(15-8-5-11-23-15)21-16-9-3-4-10-22(16)18/h1-12H
InChIKeyNPGDBBGKJFIMEJ-UHFFFAOYSA-N
XLogP5.00
TPSA42.80 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.77
LogP ≤ 55.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-(2-chlorophenyl)-N-[2-(furan-2-yl)imidazo[1,2-a]pyridin-3-yl]methanimine?
The IUPAC name of 1-(2-chlorophenyl)-N-[2-(furan-2-yl)imidazo[1,2-a]pyridin-3-yl]methanimine (CID 682392) is 1-(2-chlorophenyl)-N-[2-(furan-2-yl)imidazo[1,2-a]pyridin-3-yl]methanimine.
What is the SMILES notation for 1-(2-chlorophenyl)-N-[2-(furan-2-yl)imidazo[1,2-a]pyridin-3-yl]methanimine?
The canonical SMILES for 1-(2-chlorophenyl)-N-[2-(furan-2-yl)imidazo[1,2-a]pyridin-3-yl]methanimine is Clc1ccccc1C=Nc1c(-c2ccco2)nc2ccccn12.
What is the InChIKey of 1-(2-chlorophenyl)-N-[2-(furan-2-yl)imidazo[1,2-a]pyridin-3-yl]methanimine?
The InChIKey is NPGDBBGKJFIMEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H12ClN3O/c19-14-7-2-1-6-13(14)12-20-18-17(15-8-5-11-23-15)21-16-9-3-4-10-22(16)18/h1-12H.
What are the key properties of 1-(2-chlorophenyl)-N-[2-(furan-2-yl)imidazo[1,2-a]pyridin-3-yl]methanimine?
1-(2-chlorophenyl)-N-[2-(furan-2-yl)imidazo[1,2-a]pyridin-3-yl]methanimine has a molecular weight of 321.77 g/mol, XLogP of 5.00, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-chlorophenyl)-N-[2-(furan-2-yl)imidazo[1,2-a]pyridin-3-yl]methanimine is sourced from PubChem (CID 682392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).