7-imidazo[1,2-a]pyridin-6-ylisoquinolin-1-amine

C16H12N4 — CID 44525694

IUPAC7-imidazo[1,2-a]pyridin-6-ylisoquinolin-1-amine
SMILESNc1nccc2ccc(-c3ccc4nccn4c3)cc12
InChIInChI=1S/C16H12N4/c17-16-14-9-12(2-1-11(14)5-6-19-16)13-3-4-15-18-7-8-20(15)10-13/h1-10H,(H2,17,19)
InChIKeyYUJSGIUJPLJCOO-UHFFFAOYSA-N
MW260.30 g/mol
LogP3.13
Rot. Bonds1

About 7-imidazo[1,2-a]pyridin-6-ylisoquinolin-1-amine

7-imidazo[1,2-a]pyridin-6-ylisoquinolin-1-amine (PubChem CID 44525694) has the molecular formula C16H12N4 and a molecular weight of 260.30 g/mol. Its IUPAC name is 7-imidazo[1,2-a]pyridin-6-ylisoquinolin-1-amine.

Molecular Properties

Compound Name7-imidazo[1,2-a]pyridin-6-ylisoquinolin-1-amine
PubChem CID44525694
Molecular FormulaC16H12N4
Molecular Weight260.30 g/mol
Exact Mass260.11
IUPAC Name7-imidazo[1,2-a]pyridin-6-ylisoquinolin-1-amine
SMILESNc1nccc2ccc(-c3ccc4nccn4c3)cc12
InChIInChI=1S/C16H12N4/c17-16-14-9-12(2-1-11(14)5-6-19-16)13-3-4-15-18-7-8-20(15)10-13/h1-10H,(H2,17,19)
InChIKeyYUJSGIUJPLJCOO-UHFFFAOYSA-N
XLogP3.13
TPSA56.21 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.30
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 7-imidazo[1,2-a]pyridin-6-ylisoquinolin-1-amine?
The IUPAC name of 7-imidazo[1,2-a]pyridin-6-ylisoquinolin-1-amine (CID 44525694) is 7-imidazo[1,2-a]pyridin-6-ylisoquinolin-1-amine.
What is the SMILES notation for 7-imidazo[1,2-a]pyridin-6-ylisoquinolin-1-amine?
The canonical SMILES for 7-imidazo[1,2-a]pyridin-6-ylisoquinolin-1-amine is Nc1nccc2ccc(-c3ccc4nccn4c3)cc12.
What is the InChIKey of 7-imidazo[1,2-a]pyridin-6-ylisoquinolin-1-amine?
The InChIKey is YUJSGIUJPLJCOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12N4/c17-16-14-9-12(2-1-11(14)5-6-19-16)13-3-4-15-18-7-8-20(15)10-13/h1-10H,(H2,17,19).
What are the key properties of 7-imidazo[1,2-a]pyridin-6-ylisoquinolin-1-amine?
7-imidazo[1,2-a]pyridin-6-ylisoquinolin-1-amine has a molecular weight of 260.30 g/mol, XLogP of 3.13, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-imidazo[1,2-a]pyridin-6-ylisoquinolin-1-amine is sourced from PubChem (CID 44525694), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).