3,7-dimethoxy-10-methylphenoxazine

C15H15NO3 — CID 18972619

IUPAC3,7-dimethoxy-10-methylphenoxazine
SMILESCOc1ccc2c(c1)Oc1cc(OC)ccc1N2C
InChIInChI=1S/C15H15NO3/c1-16-12-6-4-10(17-2)8-14(12)19-15-9-11(18-3)5-7-13(15)16/h4-9H,1-3H3
InChIKeyLNROHNGEWXFUSM-UHFFFAOYSA-N
MW257.29 g/mol
LogP3.58
Rot. Bonds2

About 3,7-dimethoxy-10-methylphenoxazine

3,7-dimethoxy-10-methylphenoxazine (PubChem CID 18972619) has the molecular formula C15H15NO3 and a molecular weight of 257.29 g/mol. Its IUPAC name is 3,7-dimethoxy-10-methylphenoxazine.

Molecular Properties

Compound Name3,7-dimethoxy-10-methylphenoxazine
PubChem CID18972619
Molecular FormulaC15H15NO3
Molecular Weight257.29 g/mol
Exact Mass257.11
IUPAC Name3,7-dimethoxy-10-methylphenoxazine
SMILESCOc1ccc2c(c1)Oc1cc(OC)ccc1N2C
InChIInChI=1S/C15H15NO3/c1-16-12-6-4-10(17-2)8-14(12)19-15-9-11(18-3)5-7-13(15)16/h4-9H,1-3H3
InChIKeyLNROHNGEWXFUSM-UHFFFAOYSA-N
XLogP3.58
TPSA30.93 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.29
LogP ≤ 53.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3,7-dimethoxy-10-methylphenoxazine?
The IUPAC name of 3,7-dimethoxy-10-methylphenoxazine (CID 18972619) is 3,7-dimethoxy-10-methylphenoxazine.
What is the SMILES notation for 3,7-dimethoxy-10-methylphenoxazine?
The canonical SMILES for 3,7-dimethoxy-10-methylphenoxazine is COc1ccc2c(c1)Oc1cc(OC)ccc1N2C.
What is the InChIKey of 3,7-dimethoxy-10-methylphenoxazine?
The InChIKey is LNROHNGEWXFUSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15NO3/c1-16-12-6-4-10(17-2)8-14(12)19-15-9-11(18-3)5-7-13(15)16/h4-9H,1-3H3.
What are the key properties of 3,7-dimethoxy-10-methylphenoxazine?
3,7-dimethoxy-10-methylphenoxazine has a molecular weight of 257.29 g/mol, XLogP of 3.58, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3,7-dimethoxy-10-methylphenoxazine is sourced from PubChem (CID 18972619), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).