N-(2-methoxyethyl)-N'-methyl-N'-(quinoxalin-2-ylmethyl)ethane-1,2-diamine

C15H22N4O — CID 107355866

IUPACN-(2-methoxyethyl)-N'-methyl-N'-(quinoxalin-2-ylmethyl)ethane-1,2-diamine
SMILESCOCCNCCN(C)Cc1cnc2ccccc2n1
InChIInChI=1S/C15H22N4O/c1-19(9-7-16-8-10-20-2)12-13-11-17-14-5-3-4-6-15(14)18-13/h3-6,11,16H,7-10,12H2,1-2H3
InChIKeyCWAPXYMRIWKZHP-UHFFFAOYSA-N
MW274.37 g/mol
LogP1.30
Rot. Bonds8

About N-(2-methoxyethyl)-N'-methyl-N'-(quinoxalin-2-ylmethyl)ethane-1,2-diamine

N-(2-methoxyethyl)-N'-methyl-N'-(quinoxalin-2-ylmethyl)ethane-1,2-diamine (PubChem CID 107355866) has the molecular formula C15H22N4O and a molecular weight of 274.37 g/mol. Its IUPAC name is N-(2-methoxyethyl)-N'-methyl-N'-(quinoxalin-2-ylmethyl)ethane-1,2-diamine.

Molecular Properties

Compound NameN-(2-methoxyethyl)-N'-methyl-N'-(quinoxalin-2-ylmethyl)ethane-1,2-diamine
PubChem CID107355866
Molecular FormulaC15H22N4O
Molecular Weight274.37 g/mol
Exact Mass274.18
IUPAC NameN-(2-methoxyethyl)-N'-methyl-N'-(quinoxalin-2-ylmethyl)ethane-1,2-diamine
SMILESCOCCNCCN(C)Cc1cnc2ccccc2n1
InChIInChI=1S/C15H22N4O/c1-19(9-7-16-8-10-20-2)12-13-11-17-14-5-3-4-6-15(14)18-13/h3-6,11,16H,7-10,12H2,1-2H3
InChIKeyCWAPXYMRIWKZHP-UHFFFAOYSA-N
XLogP1.30
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.37
LogP ≤ 51.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-N'-methyl-N'-(quinoxalin-2-ylmethyl)ethane-1,2-diamine?
The IUPAC name of N-(2-methoxyethyl)-N'-methyl-N'-(quinoxalin-2-ylmethyl)ethane-1,2-diamine (CID 107355866) is N-(2-methoxyethyl)-N'-methyl-N'-(quinoxalin-2-ylmethyl)ethane-1,2-diamine.
What is the SMILES notation for N-(2-methoxyethyl)-N'-methyl-N'-(quinoxalin-2-ylmethyl)ethane-1,2-diamine?
The canonical SMILES for N-(2-methoxyethyl)-N'-methyl-N'-(quinoxalin-2-ylmethyl)ethane-1,2-diamine is COCCNCCN(C)Cc1cnc2ccccc2n1.
What is the InChIKey of N-(2-methoxyethyl)-N'-methyl-N'-(quinoxalin-2-ylmethyl)ethane-1,2-diamine?
The InChIKey is CWAPXYMRIWKZHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N4O/c1-19(9-7-16-8-10-20-2)12-13-11-17-14-5-3-4-6-15(14)18-13/h3-6,11,16H,7-10,12H2,1-2H3.
What are the key properties of N-(2-methoxyethyl)-N'-methyl-N'-(quinoxalin-2-ylmethyl)ethane-1,2-diamine?
N-(2-methoxyethyl)-N'-methyl-N'-(quinoxalin-2-ylmethyl)ethane-1,2-diamine has a molecular weight of 274.37 g/mol, XLogP of 1.30, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-N'-methyl-N'-(quinoxalin-2-ylmethyl)ethane-1,2-diamine is sourced from PubChem (CID 107355866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).