1-(3-methyl-2-pyridinyl)-10H-phenoxazine

C18H14N2O — CID 122540457

IUPAC1-(3-methyl-2-pyridinyl)-10H-phenoxazine
SMILESCc1cccnc1-c1cccc2c1Nc1ccccc1O2
InChIInChI=1S/C18H14N2O/c1-12-6-5-11-19-17(12)13-7-4-10-16-18(13)20-14-8-2-3-9-15(14)21-16/h2-11,20H,1H3
InChIKeyAAFZLFFGAQPYJK-UHFFFAOYSA-N
MW274.32 g/mol
LogP4.91
Rot. Bonds1

About 1-(3-methyl-2-pyridinyl)-10H-phenoxazine

1-(3-methyl-2-pyridinyl)-10H-phenoxazine (PubChem CID 122540457) has the molecular formula C18H14N2O and a molecular weight of 274.32 g/mol. Its IUPAC name is 1-(3-methyl-2-pyridinyl)-10H-phenoxazine.

Molecular Properties

Compound Name1-(3-methyl-2-pyridinyl)-10H-phenoxazine
PubChem CID122540457
Molecular FormulaC18H14N2O
Molecular Weight274.32 g/mol
Exact Mass274.11
IUPAC Name1-(3-methyl-2-pyridinyl)-10H-phenoxazine
SMILESCc1cccnc1-c1cccc2c1Nc1ccccc1O2
InChIInChI=1S/C18H14N2O/c1-12-6-5-11-19-17(12)13-7-4-10-16-18(13)20-14-8-2-3-9-15(14)21-16/h2-11,20H,1H3
InChIKeyAAFZLFFGAQPYJK-UHFFFAOYSA-N
XLogP4.91
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.32
LogP ≤ 54.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(3-methyl-2-pyridinyl)-10H-phenoxazine?
The IUPAC name of 1-(3-methyl-2-pyridinyl)-10H-phenoxazine (CID 122540457) is 1-(3-methyl-2-pyridinyl)-10H-phenoxazine.
What is the SMILES notation for 1-(3-methyl-2-pyridinyl)-10H-phenoxazine?
The canonical SMILES for 1-(3-methyl-2-pyridinyl)-10H-phenoxazine is Cc1cccnc1-c1cccc2c1Nc1ccccc1O2.
What is the InChIKey of 1-(3-methyl-2-pyridinyl)-10H-phenoxazine?
The InChIKey is AAFZLFFGAQPYJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14N2O/c1-12-6-5-11-19-17(12)13-7-4-10-16-18(13)20-14-8-2-3-9-15(14)21-16/h2-11,20H,1H3.
What are the key properties of 1-(3-methyl-2-pyridinyl)-10H-phenoxazine?
1-(3-methyl-2-pyridinyl)-10H-phenoxazine has a molecular weight of 274.32 g/mol, XLogP of 4.91, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-methyl-2-pyridinyl)-10H-phenoxazine is sourced from PubChem (CID 122540457), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).