2-(2-propan-2-yldibenzofuran-4-yl)pyridine

C20H17NO — CID 156686806

IUPAC2-(2-propan-2-yldibenzofuran-4-yl)pyridine
SMILESCC(C)c1cc(-c2ccccn2)c2oc3ccccc3c2c1
InChIInChI=1S/C20H17NO/c1-13(2)14-11-16-15-7-3-4-9-19(15)22-20(16)17(12-14)18-8-5-6-10-21-18/h3-13H,1-2H3
InChIKeyGWKGQRSCNVHCPD-UHFFFAOYSA-N
MW287.36 g/mol
LogP5.77
Rot. Bonds2

About 2-(2-propan-2-yldibenzofuran-4-yl)pyridine

2-(2-propan-2-yldibenzofuran-4-yl)pyridine (PubChem CID 156686806) has the molecular formula C20H17NO and a molecular weight of 287.36 g/mol. Its IUPAC name is 2-(2-propan-2-yldibenzofuran-4-yl)pyridine.

Molecular Properties

Compound Name2-(2-propan-2-yldibenzofuran-4-yl)pyridine
PubChem CID156686806
Molecular FormulaC20H17NO
Molecular Weight287.36 g/mol
Exact Mass287.13
IUPAC Name2-(2-propan-2-yldibenzofuran-4-yl)pyridine
SMILESCC(C)c1cc(-c2ccccn2)c2oc3ccccc3c2c1
InChIInChI=1S/C20H17NO/c1-13(2)14-11-16-15-7-3-4-9-19(15)22-20(16)17(12-14)18-8-5-6-10-21-18/h3-13H,1-2H3
InChIKeyGWKGQRSCNVHCPD-UHFFFAOYSA-N
XLogP5.77
TPSA26.03 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500287.36
LogP ≤ 55.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 71236331
2-dibenzofuran-4-ylpyridine
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2-dibenzofuran-4-yl-5-propan-2-ylpyridine
CID 71236317
4-(4-propan-2-yl-2-pyridinyl)-[1]benzofuro[3,2-c]pyridine
CID 90140758
4-bromo-2-propan-2-yldibenzofuran
CID 166912960
2-(3-methyldibenzofuran-4-yl)pyridine
CID 118074682
2-dibenzofuran-4-yl-4-(1-phenylethyl)pyridine
CID 162707337
4-propan-2-yl-2-(7-propan-2-yldibenzofuran-4-yl)pyridine
CID 140607533
4-pyridin-2-ylxanthen-9-one
CID 167260109
1-(6-dibenzofuran-4-yl-2-pyridinyl)-8-pyridin-2-yl-9H-carbazole
CID 140902322
4-[4-[4-(4-propan-2-ylphenyl)phenyl]phenyl]dibenzofuran
CID 67963999
2-(2,6-dimethyldibenzofuran-4-yl)pyridine
CID 156686870

Frequently Asked Questions

What is the IUPAC name of 2-(2-propan-2-yldibenzofuran-4-yl)pyridine?
The IUPAC name of 2-(2-propan-2-yldibenzofuran-4-yl)pyridine (CID 156686806) is 2-(2-propan-2-yldibenzofuran-4-yl)pyridine.
What is the SMILES notation for 2-(2-propan-2-yldibenzofuran-4-yl)pyridine?
The canonical SMILES for 2-(2-propan-2-yldibenzofuran-4-yl)pyridine is CC(C)c1cc(-c2ccccn2)c2oc3ccccc3c2c1.
What is the InChIKey of 2-(2-propan-2-yldibenzofuran-4-yl)pyridine?
The InChIKey is GWKGQRSCNVHCPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17NO/c1-13(2)14-11-16-15-7-3-4-9-19(15)22-20(16)17(12-14)18-8-5-6-10-21-18/h3-13H,1-2H3.
What are the key properties of 2-(2-propan-2-yldibenzofuran-4-yl)pyridine?
2-(2-propan-2-yldibenzofuran-4-yl)pyridine has a molecular weight of 287.36 g/mol, XLogP of 5.77, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-propan-2-yldibenzofuran-4-yl)pyridine is sourced from PubChem (CID 156686806), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).