4-[(E)-2-dibenzofuran-2-ylethenyl]-2-methylpyridine

C20H15NO — CID 126725895

IUPAC4-[(E)-2-dibenzofuran-2-ylethenyl]-2-methylpyridine
SMILESCc1cc(/C=C/c2ccc3oc4ccccc4c3c2)ccn1
InChIInChI=1S/C20H15NO/c1-14-12-16(10-11-21-14)7-6-15-8-9-20-18(13-15)17-4-2-3-5-19(17)22-20/h2-13H,1H3/b7-6+
InChIKeyANVIBTFWRMSFDI-VOTSOKGWSA-N
MW285.35 g/mol
LogP5.46
Rot. Bonds2

About 4-[(E)-2-dibenzofuran-2-ylethenyl]-2-methylpyridine

4-[(E)-2-dibenzofuran-2-ylethenyl]-2-methylpyridine (PubChem CID 126725895) has the molecular formula C20H15NO and a molecular weight of 285.35 g/mol. Its IUPAC name is 4-[(E)-2-dibenzofuran-2-ylethenyl]-2-methylpyridine.

Molecular Properties

Compound Name4-[(E)-2-dibenzofuran-2-ylethenyl]-2-methylpyridine
PubChem CID126725895
Molecular FormulaC20H15NO
Molecular Weight285.35 g/mol
Exact Mass285.12
IUPAC Name4-[(E)-2-dibenzofuran-2-ylethenyl]-2-methylpyridine
SMILESCc1cc(/C=C/c2ccc3oc4ccccc4c3c2)ccn1
InChIInChI=1S/C20H15NO/c1-14-12-16(10-11-21-14)7-6-15-8-9-20-18(13-15)17-4-2-3-5-19(17)22-20/h2-13H,1H3/b7-6+
InChIKeyANVIBTFWRMSFDI-VOTSOKGWSA-N
XLogP5.46
TPSA26.03 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms22
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500285.35
LogP ≤ 55.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-[(E)-2-dibenzofuran-2-ylethenyl]-2-methylpyridine?
The IUPAC name of 4-[(E)-2-dibenzofuran-2-ylethenyl]-2-methylpyridine (CID 126725895) is 4-[(E)-2-dibenzofuran-2-ylethenyl]-2-methylpyridine.
What is the SMILES notation for 4-[(E)-2-dibenzofuran-2-ylethenyl]-2-methylpyridine?
The canonical SMILES for 4-[(E)-2-dibenzofuran-2-ylethenyl]-2-methylpyridine is Cc1cc(/C=C/c2ccc3oc4ccccc4c3c2)ccn1.
What is the InChIKey of 4-[(E)-2-dibenzofuran-2-ylethenyl]-2-methylpyridine?
The InChIKey is ANVIBTFWRMSFDI-VOTSOKGWSA-N. The full InChI is InChI=1S/C20H15NO/c1-14-12-16(10-11-21-14)7-6-15-8-9-20-18(13-15)17-4-2-3-5-19(17)22-20/h2-13H,1H3/b7-6+.
What are the key properties of 4-[(E)-2-dibenzofuran-2-ylethenyl]-2-methylpyridine?
4-[(E)-2-dibenzofuran-2-ylethenyl]-2-methylpyridine has a molecular weight of 285.35 g/mol, XLogP of 5.46, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(E)-2-dibenzofuran-2-ylethenyl]-2-methylpyridine is sourced from PubChem (CID 126725895), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).