2,3-bis[2-(2-methoxyethoxy)ethoxy]phenazine

C22H28N2O6 — CID 156904974

IUPAC2,3-bis[2-(2-methoxyethoxy)ethoxy]phenazine
SMILESCOCCOCCOc1cc2nc3ccccc3nc2cc1OCCOCCOC
InChIInChI=1S/C22H28N2O6/c1-25-7-9-27-11-13-29-21-15-19-20(24-18-6-4-3-5-17(18)23-19)16-22(21)30-14-12-28-10-8-26-2/h3-6,15-16H,7-14H2,1-2H3
InChIKeyRPWDGYGLFVRWHP-UHFFFAOYSA-N
MW416.47 g/mol
LogP2.87
Rot. Bonds14

About 2,3-bis[2-(2-methoxyethoxy)ethoxy]phenazine

2,3-bis[2-(2-methoxyethoxy)ethoxy]phenazine (PubChem CID 156904974) has the molecular formula C22H28N2O6 and a molecular weight of 416.47 g/mol. Its IUPAC name is 2,3-bis[2-(2-methoxyethoxy)ethoxy]phenazine.

Molecular Properties

Compound Name2,3-bis[2-(2-methoxyethoxy)ethoxy]phenazine
PubChem CID156904974
Molecular FormulaC22H28N2O6
Molecular Weight416.47 g/mol
Exact Mass416.19
IUPAC Name2,3-bis[2-(2-methoxyethoxy)ethoxy]phenazine
SMILESCOCCOCCOc1cc2nc3ccccc3nc2cc1OCCOCCOC
InChIInChI=1S/C22H28N2O6/c1-25-7-9-27-11-13-29-21-15-19-20(24-18-6-4-3-5-17(18)23-19)16-22(21)30-14-12-28-10-8-26-2/h3-6,15-16H,7-14H2,1-2H3
InChIKeyRPWDGYGLFVRWHP-UHFFFAOYSA-N
XLogP2.87
TPSA81.16 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds14
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500416.47
LogP ≤ 52.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

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Related Compounds

1-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]benzene
CID 102202030
2,3-bis(2-methoxyethoxy)quinoline
CID 140540726
2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]-1,3-benzothiazole
CID 141369709
2-[(3,4,5-tridodecoxyphenyl)methyl]-13-[[3,4,5-tris[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]methyl]-2,4,11,13,15,22-hexazapentacyclo[12.8.0.03,12.05,10.016,21]docosa-1(22),3,5,7,9,11,14,16,18,20-decaene
CID 132542894
[4-(2-methoxyethoxy)quinolin-2-yl]methanol
CID 63376021
[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]methanamine
CID 104559788
1-tert-butyl-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]benzene
CID 104567723
ethane;2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxybenzene
CID 154643071
1,4-diiodo-2,5-bis[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]benzene
CID 67250875
6-[3,4-bis[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]phenyl]-1,3,5-triazine-2,4-diamine
CID 177461008
2-chloro-6-methoxy-7-(2-methoxyethoxy)quinoxaline
CID 142746011
4-[2-(2-methoxyethoxy)ethoxy]quinazoline-2-carboxylic acid
CID 104560492

Frequently Asked Questions

What is the IUPAC name of 2,3-bis[2-(2-methoxyethoxy)ethoxy]phenazine?
The IUPAC name of 2,3-bis[2-(2-methoxyethoxy)ethoxy]phenazine (CID 156904974) is 2,3-bis[2-(2-methoxyethoxy)ethoxy]phenazine.
What is the SMILES notation for 2,3-bis[2-(2-methoxyethoxy)ethoxy]phenazine?
The canonical SMILES for 2,3-bis[2-(2-methoxyethoxy)ethoxy]phenazine is COCCOCCOc1cc2nc3ccccc3nc2cc1OCCOCCOC.
What is the InChIKey of 2,3-bis[2-(2-methoxyethoxy)ethoxy]phenazine?
The InChIKey is RPWDGYGLFVRWHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H28N2O6/c1-25-7-9-27-11-13-29-21-15-19-20(24-18-6-4-3-5-17(18)23-19)16-22(21)30-14-12-28-10-8-26-2/h3-6,15-16H,7-14H2,1-2H3.
What are the key properties of 2,3-bis[2-(2-methoxyethoxy)ethoxy]phenazine?
2,3-bis[2-(2-methoxyethoxy)ethoxy]phenazine has a molecular weight of 416.47 g/mol, XLogP of 2.87, 14 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-bis[2-(2-methoxyethoxy)ethoxy]phenazine is sourced from PubChem (CID 156904974), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).