5,10-diethyl-1,2-dimethyl-7-(trifluoromethyl)phenazine

C19H21F3N2 — CID 19350148

IUPAC5,10-diethyl-1,2-dimethyl-7-(trifluoromethyl)phenazine
SMILESCCN1c2cc(C(F)(F)F)ccc2N(CC)c2c1ccc(C)c2C
InChIInChI=1S/C19H21F3N2/c1-5-23-16-9-7-12(3)13(4)18(16)24(6-2)15-10-8-14(11-17(15)23)19(20,21)22/h7-11H,5-6H2,1-4H3
InChIKeyAJTRMNKIKYUDKB-UHFFFAOYSA-N
MW334.39 g/mol
LogP5.95
Rot. Bonds2

About 5,10-diethyl-1,2-dimethyl-7-(trifluoromethyl)phenazine

5,10-diethyl-1,2-dimethyl-7-(trifluoromethyl)phenazine (PubChem CID 19350148) has the molecular formula C19H21F3N2 and a molecular weight of 334.39 g/mol. Its IUPAC name is 5,10-diethyl-1,2-dimethyl-7-(trifluoromethyl)phenazine.

Molecular Properties

Compound Name5,10-diethyl-1,2-dimethyl-7-(trifluoromethyl)phenazine
PubChem CID19350148
Molecular FormulaC19H21F3N2
Molecular Weight334.39 g/mol
Exact Mass334.17
IUPAC Name5,10-diethyl-1,2-dimethyl-7-(trifluoromethyl)phenazine
SMILESCCN1c2cc(C(F)(F)F)ccc2N(CC)c2c1ccc(C)c2C
InChIInChI=1S/C19H21F3N2/c1-5-23-16-9-7-12(3)13(4)18(16)24(6-2)15-10-8-14(11-17(15)23)19(20,21)22/h7-11H,5-6H2,1-4H3
InChIKeyAJTRMNKIKYUDKB-UHFFFAOYSA-N
XLogP5.95
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500334.39
LogP ≤ 55.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

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N-ethyl-2-methyl-5-(trifluoromethyl)aniline
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1-tert-butyl-4-[2-methyl-5-(trifluoromethyl)phenyl]piperazine
CID 130454920
2-bromo-1-methyl-4-(trifluoromethyl)benzene
CID 2779376
1,2-dimethyl-4-[[2-methyl-4-(trifluoromethyl)phenyl]methyl]-5-(trifluoromethyl)benzene
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1-(1-chloropropyl)-2-methyl-4-(trifluoromethyl)benzene
CID 130480328
2-[3-[1,3-diethyl-5-(trifluoromethyl)benzimidazol-1-ium-2-yl]prop-2-enylidene]-1,3-diethyl-5-(trifluoromethyl)benzimidazole
CID 72740551
2-[3-[1,3-diethyl-5-(trifluoromethyl)benzimidazol-1-ium-2-yl]prop-2-enylidene]-1,3-diethyl-5-(trifluoromethyl)benzimidazole iodide
CID 178184549

Frequently Asked Questions

What is the IUPAC name of 5,10-diethyl-1,2-dimethyl-7-(trifluoromethyl)phenazine?
The IUPAC name of 5,10-diethyl-1,2-dimethyl-7-(trifluoromethyl)phenazine (CID 19350148) is 5,10-diethyl-1,2-dimethyl-7-(trifluoromethyl)phenazine.
What is the SMILES notation for 5,10-diethyl-1,2-dimethyl-7-(trifluoromethyl)phenazine?
The canonical SMILES for 5,10-diethyl-1,2-dimethyl-7-(trifluoromethyl)phenazine is CCN1c2cc(C(F)(F)F)ccc2N(CC)c2c1ccc(C)c2C.
What is the InChIKey of 5,10-diethyl-1,2-dimethyl-7-(trifluoromethyl)phenazine?
The InChIKey is AJTRMNKIKYUDKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21F3N2/c1-5-23-16-9-7-12(3)13(4)18(16)24(6-2)15-10-8-14(11-17(15)23)19(20,21)22/h7-11H,5-6H2,1-4H3.
What are the key properties of 5,10-diethyl-1,2-dimethyl-7-(trifluoromethyl)phenazine?
5,10-diethyl-1,2-dimethyl-7-(trifluoromethyl)phenazine has a molecular weight of 334.39 g/mol, XLogP of 5.95, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5,10-diethyl-1,2-dimethyl-7-(trifluoromethyl)phenazine is sourced from PubChem (CID 19350148), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).