3-(2,3-dihydro-1H-imidazo[4,5-b]pyridin-6-yl)quinoline

C15H12N4 — CID 123538110

IUPAC3-(2,3-dihydro-1H-imidazo[4,5-b]pyridin-6-yl)quinoline
SMILESc1ccc2ncc(-c3cnc4c(c3)NCN4)cc2c1
InChIInChI=1S/C15H12N4/c1-2-4-13-10(3-1)5-11(7-16-13)12-6-14-15(17-8-12)19-9-18-14/h1-8,18H,9H2,(H,17,19)
InChIKeyIBXAHWZHKHMQAR-UHFFFAOYSA-N
MW248.29 g/mol
LogP3.09
Rot. Bonds1

About 3-(2,3-dihydro-1H-imidazo[4,5-b]pyridin-6-yl)quinoline

3-(2,3-dihydro-1H-imidazo[4,5-b]pyridin-6-yl)quinoline (PubChem CID 123538110) has the molecular formula C15H12N4 and a molecular weight of 248.29 g/mol. Its IUPAC name is 3-(2,3-dihydro-1H-imidazo[4,5-b]pyridin-6-yl)quinoline.

Molecular Properties

Compound Name3-(2,3-dihydro-1H-imidazo[4,5-b]pyridin-6-yl)quinoline
PubChem CID123538110
Molecular FormulaC15H12N4
Molecular Weight248.29 g/mol
Exact Mass248.11
IUPAC Name3-(2,3-dihydro-1H-imidazo[4,5-b]pyridin-6-yl)quinoline
SMILESc1ccc2ncc(-c3cnc4c(c3)NCN4)cc2c1
InChIInChI=1S/C15H12N4/c1-2-4-13-10(3-1)5-11(7-16-13)12-6-14-15(17-8-12)19-9-18-14/h1-8,18H,9H2,(H,17,19)
InChIKeyIBXAHWZHKHMQAR-UHFFFAOYSA-N
XLogP3.09
TPSA49.84 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.29
LogP ≤ 53.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-(2,3-dihydro-1H-imidazo[4,5-b]pyridin-6-yl)quinoline?
The IUPAC name of 3-(2,3-dihydro-1H-imidazo[4,5-b]pyridin-6-yl)quinoline (CID 123538110) is 3-(2,3-dihydro-1H-imidazo[4,5-b]pyridin-6-yl)quinoline.
What is the SMILES notation for 3-(2,3-dihydro-1H-imidazo[4,5-b]pyridin-6-yl)quinoline?
The canonical SMILES for 3-(2,3-dihydro-1H-imidazo[4,5-b]pyridin-6-yl)quinoline is c1ccc2ncc(-c3cnc4c(c3)NCN4)cc2c1.
What is the InChIKey of 3-(2,3-dihydro-1H-imidazo[4,5-b]pyridin-6-yl)quinoline?
The InChIKey is IBXAHWZHKHMQAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12N4/c1-2-4-13-10(3-1)5-11(7-16-13)12-6-14-15(17-8-12)19-9-18-14/h1-8,18H,9H2,(H,17,19).
What are the key properties of 3-(2,3-dihydro-1H-imidazo[4,5-b]pyridin-6-yl)quinoline?
3-(2,3-dihydro-1H-imidazo[4,5-b]pyridin-6-yl)quinoline has a molecular weight of 248.29 g/mol, XLogP of 3.09, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,3-dihydro-1H-imidazo[4,5-b]pyridin-6-yl)quinoline is sourced from PubChem (CID 123538110), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).