6,7-dimethyl-3-naphthalen-1-ylimidazo[4,5-b]pyridine

C18H15N3 — CID 59841549

IUPAC6,7-dimethyl-3-naphthalen-1-ylimidazo[4,5-b]pyridine
SMILESCc1cnc2c(ncn2-c2cccc3ccccc23)c1C
InChIInChI=1S/C18H15N3/c1-12-10-19-18-17(13(12)2)20-11-21(18)16-9-5-7-14-6-3-4-8-15(14)16/h3-11H,1-2H3
InChIKeyYIKQTCZGYMWQNM-UHFFFAOYSA-N
MW273.34 g/mol
LogP4.19
Rot. Bonds1

About 6,7-dimethyl-3-naphthalen-1-ylimidazo[4,5-b]pyridine

6,7-dimethyl-3-naphthalen-1-ylimidazo[4,5-b]pyridine (PubChem CID 59841549) has the molecular formula C18H15N3 and a molecular weight of 273.34 g/mol. Its IUPAC name is 6,7-dimethyl-3-naphthalen-1-ylimidazo[4,5-b]pyridine.

Molecular Properties

Compound Name6,7-dimethyl-3-naphthalen-1-ylimidazo[4,5-b]pyridine
PubChem CID59841549
Molecular FormulaC18H15N3
Molecular Weight273.34 g/mol
Exact Mass273.13
IUPAC Name6,7-dimethyl-3-naphthalen-1-ylimidazo[4,5-b]pyridine
SMILESCc1cnc2c(ncn2-c2cccc3ccccc23)c1C
InChIInChI=1S/C18H15N3/c1-12-10-19-18-17(13(12)2)20-11-21(18)16-9-5-7-14-6-3-4-8-15(14)16/h3-11H,1-2H3
InChIKeyYIKQTCZGYMWQNM-UHFFFAOYSA-N
XLogP4.19
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.34
LogP ≤ 54.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6,7-dimethyl-3-naphthalen-1-ylimidazo[4,5-b]pyridine?
The IUPAC name of 6,7-dimethyl-3-naphthalen-1-ylimidazo[4,5-b]pyridine (CID 59841549) is 6,7-dimethyl-3-naphthalen-1-ylimidazo[4,5-b]pyridine.
What is the SMILES notation for 6,7-dimethyl-3-naphthalen-1-ylimidazo[4,5-b]pyridine?
The canonical SMILES for 6,7-dimethyl-3-naphthalen-1-ylimidazo[4,5-b]pyridine is Cc1cnc2c(ncn2-c2cccc3ccccc23)c1C.
What is the InChIKey of 6,7-dimethyl-3-naphthalen-1-ylimidazo[4,5-b]pyridine?
The InChIKey is YIKQTCZGYMWQNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15N3/c1-12-10-19-18-17(13(12)2)20-11-21(18)16-9-5-7-14-6-3-4-8-15(14)16/h3-11H,1-2H3.
What are the key properties of 6,7-dimethyl-3-naphthalen-1-ylimidazo[4,5-b]pyridine?
6,7-dimethyl-3-naphthalen-1-ylimidazo[4,5-b]pyridine has a molecular weight of 273.34 g/mol, XLogP of 4.19, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6,7-dimethyl-3-naphthalen-1-ylimidazo[4,5-b]pyridine is sourced from PubChem (CID 59841549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).