5,5-bis(pyridin-4-ylmethyl)indeno[1,2-b]pyridine

C24H19N3 — CID 10545749

IUPAC5,5-bis(pyridin-4-ylmethyl)indeno[1,2-b]pyridine
SMILESc1ccc2c(c1)-c1ncccc1C2(Cc1ccncc1)Cc1ccncc1
InChIInChI=1S/C24H19N3/c1-2-5-21-20(4-1)23-22(6-3-11-27-23)24(21,16-18-7-12-25-13-8-18)17-19-9-14-26-15-10-19/h1-15H,16-17H2
InChIKeyAVQJIVUHTCZMKP-UHFFFAOYSA-N
MW349.44 g/mol
LogP4.62
Rot. Bonds4

About 5,5-bis(pyridin-4-ylmethyl)indeno[1,2-b]pyridine

5,5-bis(pyridin-4-ylmethyl)indeno[1,2-b]pyridine (PubChem CID 10545749) has the molecular formula C24H19N3 and a molecular weight of 349.44 g/mol. Its IUPAC name is 5,5-bis(pyridin-4-ylmethyl)indeno[1,2-b]pyridine.

Molecular Properties

Compound Name5,5-bis(pyridin-4-ylmethyl)indeno[1,2-b]pyridine
PubChem CID10545749
Molecular FormulaC24H19N3
Molecular Weight349.44 g/mol
Exact Mass349.16
IUPAC Name5,5-bis(pyridin-4-ylmethyl)indeno[1,2-b]pyridine
SMILESc1ccc2c(c1)-c1ncccc1C2(Cc1ccncc1)Cc1ccncc1
InChIInChI=1S/C24H19N3/c1-2-5-21-20(4-1)23-22(6-3-11-27-23)24(21,16-18-7-12-25-13-8-18)17-19-9-14-26-15-10-19/h1-15H,16-17H2
InChIKeyAVQJIVUHTCZMKP-UHFFFAOYSA-N
XLogP4.62
TPSA38.67 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.44
LogP ≤ 54.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5,5-bis(pyridin-4-ylmethyl)indeno[1,2-b]pyridine?
The IUPAC name of 5,5-bis(pyridin-4-ylmethyl)indeno[1,2-b]pyridine (CID 10545749) is 5,5-bis(pyridin-4-ylmethyl)indeno[1,2-b]pyridine.
What is the SMILES notation for 5,5-bis(pyridin-4-ylmethyl)indeno[1,2-b]pyridine?
The canonical SMILES for 5,5-bis(pyridin-4-ylmethyl)indeno[1,2-b]pyridine is c1ccc2c(c1)-c1ncccc1C2(Cc1ccncc1)Cc1ccncc1.
What is the InChIKey of 5,5-bis(pyridin-4-ylmethyl)indeno[1,2-b]pyridine?
The InChIKey is AVQJIVUHTCZMKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H19N3/c1-2-5-21-20(4-1)23-22(6-3-11-27-23)24(21,16-18-7-12-25-13-8-18)17-19-9-14-26-15-10-19/h1-15H,16-17H2.
What are the key properties of 5,5-bis(pyridin-4-ylmethyl)indeno[1,2-b]pyridine?
5,5-bis(pyridin-4-ylmethyl)indeno[1,2-b]pyridine has a molecular weight of 349.44 g/mol, XLogP of 4.62, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5,5-bis(pyridin-4-ylmethyl)indeno[1,2-b]pyridine is sourced from PubChem (CID 10545749), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).