2-dibenzofuran-4-yl-4-[dideuterio(phenyl)methyl]pyridine

C24H17NO — CID 162707858

IUPAC2-dibenzofuran-4-yl-4-[dideuterio(phenyl)methyl]pyridine
SMILES[2H]C([2H])(c1ccccc1)c1ccnc(-c2cccc3c2oc2ccccc23)c1
InChIInChI=1S/C24H17NO/c1-2-7-17(8-3-1)15-18-13-14-25-22(16-18)21-11-6-10-20-19-9-4-5-12-23(19)26-24(20)21/h1-14,16H,15H2/i15D2
InChIKeyFVBFXTCHFYGLIG-DOBBINOXSA-N
MW337.42 g/mol
LogP6.24
Rot. Bonds3

About 2-dibenzofuran-4-yl-4-[dideuterio(phenyl)methyl]pyridine

2-dibenzofuran-4-yl-4-[dideuterio(phenyl)methyl]pyridine (PubChem CID 162707858) has the molecular formula C24H17NO and a molecular weight of 337.42 g/mol. Its IUPAC name is 2-dibenzofuran-4-yl-4-[dideuterio(phenyl)methyl]pyridine.

Molecular Properties

Compound Name2-dibenzofuran-4-yl-4-[dideuterio(phenyl)methyl]pyridine
PubChem CID162707858
Molecular FormulaC24H17NO
Molecular Weight337.42 g/mol
Exact Mass337.14
IUPAC Name2-dibenzofuran-4-yl-4-[dideuterio(phenyl)methyl]pyridine
SMILES[2H]C([2H])(c1ccccc1)c1ccnc(-c2cccc3c2oc2ccccc23)c1
InChIInChI=1S/C24H17NO/c1-2-7-17(8-3-1)15-18-13-14-25-22(16-18)21-11-6-10-20-19-9-4-5-12-23(19)26-24(20)21/h1-14,16H,15H2/i15D2
InChIKeyFVBFXTCHFYGLIG-DOBBINOXSA-N
XLogP6.24
TPSA26.03 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500337.42
LogP ≤ 56.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-[dideuterio(phenyl)methyl]-2-[7-(trideuteriomethyl)dibenzofuran-4-yl]pyridine
CID 162710303
2-[7-[dideuterio(phenyl)methyl]dibenzofuran-4-yl]pyridine
CID 162708063
2-[7-[dideuterio(phenyl)methyl]dibenzofuran-4-yl]-4-(4-fluorophenyl)pyridine
CID 162708942
2-dibenzofuran-4-yl-4-octylpyridine
CID 171576908
2-(3H-dibenzofuran-3-id-4-yl)-4-[dideuterio(phenyl)methyl]pyridine;2-(3H-dibenzofuran-3-id-4-yl)pyridine;iridium
CID 177279388
2-dibenzofuran-4-ylpyridine
CID 59500175
4-(1,1-dideuterio-2,2-dimethylpropyl)-2-(7-phenyldibenzofuran-4-yl)pyridine
CID 162707718
4-(2-deuteriopropan-2-yl)-2-[9-[dideuterio(phenyl)methyl]dibenzofuran-4-yl]pyridine
CID 162708909
2-dibenzofuran-4-yl-4-propan-2-ylpyridine
CID 71236331
2-dibenzofuran-4-yl-4-(1-phenylethyl)pyridine
CID 162707337
2-dibenzofuran-4-yl-4-(4-methylphenyl)pyridine
CID 140775845
4-benzyl-2-dibenzofuran-4-yl-5-methylpyridine
CID 162707040

Frequently Asked Questions

What is the IUPAC name of 2-dibenzofuran-4-yl-4-[dideuterio(phenyl)methyl]pyridine?
The IUPAC name of 2-dibenzofuran-4-yl-4-[dideuterio(phenyl)methyl]pyridine (CID 162707858) is 2-dibenzofuran-4-yl-4-[dideuterio(phenyl)methyl]pyridine.
What is the SMILES notation for 2-dibenzofuran-4-yl-4-[dideuterio(phenyl)methyl]pyridine?
The canonical SMILES for 2-dibenzofuran-4-yl-4-[dideuterio(phenyl)methyl]pyridine is [2H]C([2H])(c1ccccc1)c1ccnc(-c2cccc3c2oc2ccccc23)c1.
What is the InChIKey of 2-dibenzofuran-4-yl-4-[dideuterio(phenyl)methyl]pyridine?
The InChIKey is FVBFXTCHFYGLIG-DOBBINOXSA-N. The full InChI is InChI=1S/C24H17NO/c1-2-7-17(8-3-1)15-18-13-14-25-22(16-18)21-11-6-10-20-19-9-4-5-12-23(19)26-24(20)21/h1-14,16H,15H2/i15D2.
What are the key properties of 2-dibenzofuran-4-yl-4-[dideuterio(phenyl)methyl]pyridine?
2-dibenzofuran-4-yl-4-[dideuterio(phenyl)methyl]pyridine has a molecular weight of 337.42 g/mol, XLogP of 6.24, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-dibenzofuran-4-yl-4-[dideuterio(phenyl)methyl]pyridine is sourced from PubChem (CID 162707858), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).