7-(3,5-dimethylphenyl)-2-phenylfuro[2,3-c]pyridine

C21H17NO — CID 153444977

IUPAC7-(3,5-dimethylphenyl)-2-phenylfuro[2,3-c]pyridine
SMILESCc1cc(C)cc(-c2nccc3cc(-c4ccccc4)oc23)c1
InChIInChI=1S/C21H17NO/c1-14-10-15(2)12-18(11-14)20-21-17(8-9-22-20)13-19(23-21)16-6-4-3-5-7-16/h3-13H,1-2H3
InChIKeyMHSMOZIGRVVPRW-UHFFFAOYSA-N
MW299.37 g/mol
LogP5.78
Rot. Bonds2

About 7-(3,5-dimethylphenyl)-2-phenylfuro[2,3-c]pyridine

7-(3,5-dimethylphenyl)-2-phenylfuro[2,3-c]pyridine (PubChem CID 153444977) has the molecular formula C21H17NO and a molecular weight of 299.37 g/mol. Its IUPAC name is 7-(3,5-dimethylphenyl)-2-phenylfuro[2,3-c]pyridine.

Molecular Properties

Compound Name7-(3,5-dimethylphenyl)-2-phenylfuro[2,3-c]pyridine
PubChem CID153444977
Molecular FormulaC21H17NO
Molecular Weight299.37 g/mol
Exact Mass299.13
IUPAC Name7-(3,5-dimethylphenyl)-2-phenylfuro[2,3-c]pyridine
SMILESCc1cc(C)cc(-c2nccc3cc(-c4ccccc4)oc23)c1
InChIInChI=1S/C21H17NO/c1-14-10-15(2)12-18(11-14)20-21-17(8-9-22-20)13-19(23-21)16-6-4-3-5-7-16/h3-13H,1-2H3
InChIKeyMHSMOZIGRVVPRW-UHFFFAOYSA-N
XLogP5.78
TPSA26.03 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms23
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500299.37
LogP ≤ 55.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 7-(3,5-dimethylphenyl)-2-phenylfuro[2,3-c]pyridine?
The IUPAC name of 7-(3,5-dimethylphenyl)-2-phenylfuro[2,3-c]pyridine (CID 153444977) is 7-(3,5-dimethylphenyl)-2-phenylfuro[2,3-c]pyridine.
What is the SMILES notation for 7-(3,5-dimethylphenyl)-2-phenylfuro[2,3-c]pyridine?
The canonical SMILES for 7-(3,5-dimethylphenyl)-2-phenylfuro[2,3-c]pyridine is Cc1cc(C)cc(-c2nccc3cc(-c4ccccc4)oc23)c1.
What is the InChIKey of 7-(3,5-dimethylphenyl)-2-phenylfuro[2,3-c]pyridine?
The InChIKey is MHSMOZIGRVVPRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H17NO/c1-14-10-15(2)12-18(11-14)20-21-17(8-9-22-20)13-19(23-21)16-6-4-3-5-7-16/h3-13H,1-2H3.
What are the key properties of 7-(3,5-dimethylphenyl)-2-phenylfuro[2,3-c]pyridine?
7-(3,5-dimethylphenyl)-2-phenylfuro[2,3-c]pyridine has a molecular weight of 299.37 g/mol, XLogP of 5.78, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(3,5-dimethylphenyl)-2-phenylfuro[2,3-c]pyridine is sourced from PubChem (CID 153444977), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).