4-methyl-2-(1-methyldibenzofuran-4-yl)pyridine

C19H15NO — CID 171576824

IUPAC4-methyl-2-(1-methyldibenzofuran-4-yl)pyridine
SMILESCc1ccnc(-c2ccc(C)c3c2oc2ccccc23)c1
InChIInChI=1S/C19H15NO/c1-12-9-10-20-16(11-12)14-8-7-13(2)18-15-5-3-4-6-17(15)21-19(14)18/h3-11H,1-2H3
InChIKeyIMZSFPVXKGJFIX-UHFFFAOYSA-N
MW273.33 g/mol
LogP5.26
Rot. Bonds1

About 4-methyl-2-(1-methyldibenzofuran-4-yl)pyridine

4-methyl-2-(1-methyldibenzofuran-4-yl)pyridine (PubChem CID 171576824) has the molecular formula C19H15NO and a molecular weight of 273.33 g/mol. Its IUPAC name is 4-methyl-2-(1-methyldibenzofuran-4-yl)pyridine.

Molecular Properties

Compound Name4-methyl-2-(1-methyldibenzofuran-4-yl)pyridine
PubChem CID171576824
Molecular FormulaC19H15NO
Molecular Weight273.33 g/mol
Exact Mass273.12
IUPAC Name4-methyl-2-(1-methyldibenzofuran-4-yl)pyridine
SMILESCc1ccnc(-c2ccc(C)c3c2oc2ccccc23)c1
InChIInChI=1S/C19H15NO/c1-12-9-10-20-16(11-12)14-8-7-13(2)18-15-5-3-4-6-17(15)21-19(14)18/h3-11H,1-2H3
InChIKeyIMZSFPVXKGJFIX-UHFFFAOYSA-N
XLogP5.26
TPSA26.03 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500273.33
LogP ≤ 55.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-2-(1-methyldibenzofuran-4-yl)pyridine?
The IUPAC name of 4-methyl-2-(1-methyldibenzofuran-4-yl)pyridine (CID 171576824) is 4-methyl-2-(1-methyldibenzofuran-4-yl)pyridine.
What is the SMILES notation for 4-methyl-2-(1-methyldibenzofuran-4-yl)pyridine?
The canonical SMILES for 4-methyl-2-(1-methyldibenzofuran-4-yl)pyridine is Cc1ccnc(-c2ccc(C)c3c2oc2ccccc23)c1.
What is the InChIKey of 4-methyl-2-(1-methyldibenzofuran-4-yl)pyridine?
The InChIKey is IMZSFPVXKGJFIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15NO/c1-12-9-10-20-16(11-12)14-8-7-13(2)18-15-5-3-4-6-17(15)21-19(14)18/h3-11H,1-2H3.
What are the key properties of 4-methyl-2-(1-methyldibenzofuran-4-yl)pyridine?
4-methyl-2-(1-methyldibenzofuran-4-yl)pyridine has a molecular weight of 273.33 g/mol, XLogP of 5.26, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-2-(1-methyldibenzofuran-4-yl)pyridine is sourced from PubChem (CID 171576824), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).