2-(3-methyldibenzofuran-4-yl)pyridine

C18H13NO — CID 118074682

IUPAC2-(3-methyldibenzofuran-4-yl)pyridine
SMILESCc1ccc2c(oc3ccccc32)c1-c1ccccn1
InChIInChI=1S/C18H13NO/c1-12-9-10-14-13-6-2-3-8-16(13)20-18(14)17(12)15-7-4-5-11-19-15/h2-11H,1H3
InChIKeyDKGNFWYJFCDRAI-UHFFFAOYSA-N
MW259.31 g/mol
LogP4.96
Rot. Bonds1

About 2-(3-methyldibenzofuran-4-yl)pyridine

2-(3-methyldibenzofuran-4-yl)pyridine (PubChem CID 118074682) has the molecular formula C18H13NO and a molecular weight of 259.31 g/mol. Its IUPAC name is 2-(3-methyldibenzofuran-4-yl)pyridine.

Molecular Properties

Compound Name2-(3-methyldibenzofuran-4-yl)pyridine
PubChem CID118074682
Molecular FormulaC18H13NO
Molecular Weight259.31 g/mol
Exact Mass259.10
IUPAC Name2-(3-methyldibenzofuran-4-yl)pyridine
SMILESCc1ccc2c(oc3ccccc32)c1-c1ccccn1
InChIInChI=1S/C18H13NO/c1-12-9-10-14-13-6-2-3-8-16(13)20-18(14)17(12)15-7-4-5-11-19-15/h2-11H,1H3
InChIKeyDKGNFWYJFCDRAI-UHFFFAOYSA-N
XLogP4.96
TPSA26.03 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.31
LogP ≤ 54.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-methyl-[1]benzothiolo[3,2-b][1]benzofuran-1-yl)pyridine
CID 170112879
1-methyl-2-(3-methyldibenzofuran-4-yl)-5-pyridin-2-ylpyridin-1-ium
CID 164798219
2-dibenzofuran-4-ylpyridine
CID 59500175
1-methyl-2-(2-methyl-[1]benzofuro[3,2-b][1]benzofuran-1-yl)pyrimidin-1-ium
CID 140828050
2-(3-methyl-[1]benzofuro[2,3-b][1]benzofuran-4-yl)pyrazine
CID 170112950
2-(3,12,12-trimethylfluoreno[2,1-b][1]benzofuran-4-yl)pyridine
CID 121342988
2-(2-propan-2-yldibenzofuran-4-yl)pyridine
CID 156686806
2-(3-ethenyl-6-methyldibenzofuran-4-yl)pyridine
CID 144831188
2-(9'-methylspiro[cyclopentane-1,12'-fluoreno[1,2-b][1]benzofuran]-10'-yl)pyridine
CID 121342984
2-[4-(3-methyldibenzofuran-4-yl)phenyl]-4,6-dinaphthalen-2-yl-1,3,5-triazine
CID 176757340
7-methyl-8-(1-methyl-5-pyridin-2-ylpyridin-1-ium-2-yl)-[1]benzofuro[2,3-b]pyridine
CID 140777913
7-methyl-6-(1-methylpyridin-1-ium-2-yl)-[1]benzofuro[3,2-b]pyridine
CID 123481860

Frequently Asked Questions

What is the IUPAC name of 2-(3-methyldibenzofuran-4-yl)pyridine?
The IUPAC name of 2-(3-methyldibenzofuran-4-yl)pyridine (CID 118074682) is 2-(3-methyldibenzofuran-4-yl)pyridine.
What is the SMILES notation for 2-(3-methyldibenzofuran-4-yl)pyridine?
The canonical SMILES for 2-(3-methyldibenzofuran-4-yl)pyridine is Cc1ccc2c(oc3ccccc32)c1-c1ccccn1.
What is the InChIKey of 2-(3-methyldibenzofuran-4-yl)pyridine?
The InChIKey is DKGNFWYJFCDRAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H13NO/c1-12-9-10-14-13-6-2-3-8-16(13)20-18(14)17(12)15-7-4-5-11-19-15/h2-11H,1H3.
What are the key properties of 2-(3-methyldibenzofuran-4-yl)pyridine?
2-(3-methyldibenzofuran-4-yl)pyridine has a molecular weight of 259.31 g/mol, XLogP of 4.96, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methyldibenzofuran-4-yl)pyridine is sourced from PubChem (CID 118074682), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).