10-(3-pyridin-2-ylphenyl)phenoxazine

C23H16N2O — CID 21042147

IUPAC10-(3-pyridin-2-ylphenyl)phenoxazine
SMILESc1ccc(-c2cccc(N3c4ccccc4Oc4ccccc43)c2)nc1
InChIInChI=1S/C23H16N2O/c1-3-13-22-20(11-1)25(21-12-2-4-14-23(21)26-22)18-9-7-8-17(16-18)19-10-5-6-15-24-19/h1-16H
InChIKeyAKKVDLKLLHJLLY-UHFFFAOYSA-N
MW336.39 g/mol
LogP6.32
Rot. Bonds2

About 10-(3-pyridin-2-ylphenyl)phenoxazine

10-(3-pyridin-2-ylphenyl)phenoxazine (PubChem CID 21042147) has the molecular formula C23H16N2O and a molecular weight of 336.39 g/mol. Its IUPAC name is 10-(3-pyridin-2-ylphenyl)phenoxazine.

Molecular Properties

Compound Name10-(3-pyridin-2-ylphenyl)phenoxazine
PubChem CID21042147
Molecular FormulaC23H16N2O
Molecular Weight336.39 g/mol
Exact Mass336.13
IUPAC Name10-(3-pyridin-2-ylphenyl)phenoxazine
SMILESc1ccc(-c2cccc(N3c4ccccc4Oc4ccccc43)c2)nc1
InChIInChI=1S/C23H16N2O/c1-3-13-22-20(11-1)25(21-12-2-4-14-23(21)26-22)18-9-7-8-17(16-18)19-10-5-6-15-24-19/h1-16H
InChIKeyAKKVDLKLLHJLLY-UHFFFAOYSA-N
XLogP6.32
TPSA25.36 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500336.39
LogP ≤ 56.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 10-(3-pyridin-2-ylphenyl)phenoxazine?
The IUPAC name of 10-(3-pyridin-2-ylphenyl)phenoxazine (CID 21042147) is 10-(3-pyridin-2-ylphenyl)phenoxazine.
What is the SMILES notation for 10-(3-pyridin-2-ylphenyl)phenoxazine?
The canonical SMILES for 10-(3-pyridin-2-ylphenyl)phenoxazine is c1ccc(-c2cccc(N3c4ccccc4Oc4ccccc43)c2)nc1.
What is the InChIKey of 10-(3-pyridin-2-ylphenyl)phenoxazine?
The InChIKey is AKKVDLKLLHJLLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H16N2O/c1-3-13-22-20(11-1)25(21-12-2-4-14-23(21)26-22)18-9-7-8-17(16-18)19-10-5-6-15-24-19/h1-16H.
What are the key properties of 10-(3-pyridin-2-ylphenyl)phenoxazine?
10-(3-pyridin-2-ylphenyl)phenoxazine has a molecular weight of 336.39 g/mol, XLogP of 6.32, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 10-(3-pyridin-2-ylphenyl)phenoxazine is sourced from PubChem (CID 21042147), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).