1-(1-methylcyclodecyl)-10H-phenoxazine

C23H29NO — CID 173176361

IUPAC1-(1-methylcyclodecyl)-10H-phenoxazine
SMILESCC1(c2cccc3c2Nc2ccccc2O3)CCCCCCCCC1
InChIInChI=1S/C23H29NO/c1-23(16-9-5-3-2-4-6-10-17-23)18-12-11-15-21-22(18)24-19-13-7-8-14-20(19)25-21/h7-8,11-15,24H,2-6,9-10,16-17H2,1H3
InChIKeyUPKHJUWOYRCNRZ-UHFFFAOYSA-N
MW335.49 g/mol
LogP7.32
Rot. Bonds1

About 1-(1-methylcyclodecyl)-10H-phenoxazine

1-(1-methylcyclodecyl)-10H-phenoxazine (PubChem CID 173176361) has the molecular formula C23H29NO and a molecular weight of 335.49 g/mol. Its IUPAC name is 1-(1-methylcyclodecyl)-10H-phenoxazine.

Molecular Properties

Compound Name1-(1-methylcyclodecyl)-10H-phenoxazine
PubChem CID173176361
Molecular FormulaC23H29NO
Molecular Weight335.49 g/mol
Exact Mass335.22
IUPAC Name1-(1-methylcyclodecyl)-10H-phenoxazine
SMILESCC1(c2cccc3c2Nc2ccccc2O3)CCCCCCCCC1
InChIInChI=1S/C23H29NO/c1-23(16-9-5-3-2-4-6-10-17-23)18-12-11-15-21-22(18)24-19-13-7-8-14-20(19)25-21/h7-8,11-15,24H,2-6,9-10,16-17H2,1H3
InChIKeyUPKHJUWOYRCNRZ-UHFFFAOYSA-N
XLogP7.32
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500335.49
LogP ≤ 57.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(1-methylcyclodecyl)-10H-phenoxazine?
The IUPAC name of 1-(1-methylcyclodecyl)-10H-phenoxazine (CID 173176361) is 1-(1-methylcyclodecyl)-10H-phenoxazine.
What is the SMILES notation for 1-(1-methylcyclodecyl)-10H-phenoxazine?
The canonical SMILES for 1-(1-methylcyclodecyl)-10H-phenoxazine is CC1(c2cccc3c2Nc2ccccc2O3)CCCCCCCCC1.
What is the InChIKey of 1-(1-methylcyclodecyl)-10H-phenoxazine?
The InChIKey is UPKHJUWOYRCNRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H29NO/c1-23(16-9-5-3-2-4-6-10-17-23)18-12-11-15-21-22(18)24-19-13-7-8-14-20(19)25-21/h7-8,11-15,24H,2-6,9-10,16-17H2,1H3.
What are the key properties of 1-(1-methylcyclodecyl)-10H-phenoxazine?
1-(1-methylcyclodecyl)-10H-phenoxazine has a molecular weight of 335.49 g/mol, XLogP of 7.32, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-methylcyclodecyl)-10H-phenoxazine is sourced from PubChem (CID 173176361), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).