10-phenylphenoxazine

C18H13NO — CID 5105692

IUPAC10-phenylphenoxazine
SMILESc1ccc(N2c3ccccc3Oc3ccccc32)cc1
InChIInChI=1S/C18H13NO/c1-2-8-14(9-3-1)19-15-10-4-6-12-17(15)20-18-13-7-5-11-16(18)19/h1-13H
InChIKeyLAVLDGSVWFEKJG-UHFFFAOYSA-N
MW259.31 g/mol
LogP5.26
Rot. Bonds1

About 10-phenylphenoxazine

10-phenylphenoxazine (PubChem CID 5105692) has the molecular formula C18H13NO and a molecular weight of 259.31 g/mol. Its IUPAC name is 10-phenylphenoxazine.

Molecular Properties

Compound Name10-phenylphenoxazine
PubChem CID5105692
Molecular FormulaC18H13NO
Molecular Weight259.31 g/mol
Exact Mass259.10
IUPAC Name10-phenylphenoxazine
SMILESc1ccc(N2c3ccccc3Oc3ccccc32)cc1
InChIInChI=1S/C18H13NO/c1-2-8-14(9-3-1)19-15-10-4-6-12-17(15)20-18-13-7-5-11-16(18)19/h1-13H
InChIKeyLAVLDGSVWFEKJG-UHFFFAOYSA-N
XLogP5.26
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500259.31
LogP ≤ 55.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 10-phenylphenoxazine?
The IUPAC name of 10-phenylphenoxazine (CID 5105692) is 10-phenylphenoxazine.
What is the SMILES notation for 10-phenylphenoxazine?
The canonical SMILES for 10-phenylphenoxazine is c1ccc(N2c3ccccc3Oc3ccccc32)cc1.
What is the InChIKey of 10-phenylphenoxazine?
The InChIKey is LAVLDGSVWFEKJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H13NO/c1-2-8-14(9-3-1)19-15-10-4-6-12-17(15)20-18-13-7-5-11-16(18)19/h1-13H.
What are the key properties of 10-phenylphenoxazine?
10-phenylphenoxazine has a molecular weight of 259.31 g/mol, XLogP of 5.26, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 10-phenylphenoxazine is sourced from PubChem (CID 5105692), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).