3-(4-methoxyphenyl)-10-phenylphenoxazine

C25H19NO2 — CID 140900009

IUPAC3-(4-methoxyphenyl)-10-phenylphenoxazine
SMILESCOc1ccc(-c2ccc3c(c2)Oc2ccccc2N3c2ccccc2)cc1
InChIInChI=1S/C25H19NO2/c1-27-21-14-11-18(12-15-21)19-13-16-23-25(17-19)28-24-10-6-5-9-22(24)26(23)20-7-3-2-4-8-20/h2-17H,1H3
InChIKeyNRYLWIJCMRSAAD-UHFFFAOYSA-N
MW365.43 g/mol
LogP6.94
Rot. Bonds3

About 3-(4-methoxyphenyl)-10-phenylphenoxazine

3-(4-methoxyphenyl)-10-phenylphenoxazine (PubChem CID 140900009) has the molecular formula C25H19NO2 and a molecular weight of 365.43 g/mol. Its IUPAC name is 3-(4-methoxyphenyl)-10-phenylphenoxazine.

Molecular Properties

Compound Name3-(4-methoxyphenyl)-10-phenylphenoxazine
PubChem CID140900009
Molecular FormulaC25H19NO2
Molecular Weight365.43 g/mol
Exact Mass365.14
IUPAC Name3-(4-methoxyphenyl)-10-phenylphenoxazine
SMILESCOc1ccc(-c2ccc3c(c2)Oc2ccccc2N3c2ccccc2)cc1
InChIInChI=1S/C25H19NO2/c1-27-21-14-11-18(12-15-21)19-13-16-23-25(17-19)28-24-10-6-5-9-22(24)26(23)20-7-3-2-4-8-20/h2-17H,1H3
InChIKeyNRYLWIJCMRSAAD-UHFFFAOYSA-N
XLogP6.94
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500365.43
LogP ≤ 56.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-(4-methoxyphenyl)-10-phenylphenoxazine?
The IUPAC name of 3-(4-methoxyphenyl)-10-phenylphenoxazine (CID 140900009) is 3-(4-methoxyphenyl)-10-phenylphenoxazine.
What is the SMILES notation for 3-(4-methoxyphenyl)-10-phenylphenoxazine?
The canonical SMILES for 3-(4-methoxyphenyl)-10-phenylphenoxazine is COc1ccc(-c2ccc3c(c2)Oc2ccccc2N3c2ccccc2)cc1.
What is the InChIKey of 3-(4-methoxyphenyl)-10-phenylphenoxazine?
The InChIKey is NRYLWIJCMRSAAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H19NO2/c1-27-21-14-11-18(12-15-21)19-13-16-23-25(17-19)28-24-10-6-5-9-22(24)26(23)20-7-3-2-4-8-20/h2-17H,1H3.
What are the key properties of 3-(4-methoxyphenyl)-10-phenylphenoxazine?
3-(4-methoxyphenyl)-10-phenylphenoxazine has a molecular weight of 365.43 g/mol, XLogP of 6.94, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-methoxyphenyl)-10-phenylphenoxazine is sourced from PubChem (CID 140900009), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).