N-(5,8-dimethoxy-2,3-dimethylquinoxalin-6-yl)-N',N'-dimethylpropane-1,3-diamine

C17H26N4O2 — CID 547620

IUPACN-(5,8-dimethoxy-2,3-dimethylquinoxalin-6-yl)-N',N'-dimethylpropane-1,3-diamine
SMILESCOc1cc(NCCCN(C)C)c(OC)c2nc(C)c(C)nc12
InChIInChI=1S/C17H26N4O2/c1-11-12(2)20-16-15(19-11)14(22-5)10-13(17(16)23-6)18-8-7-9-21(3)4/h10,18H,7-9H2,1-6H3
InChIKeyLOXJXRLWVPZMAF-UHFFFAOYSA-N
MW318.42 g/mol
LogP2.63
Rot. Bonds7

About N-(5,8-dimethoxy-2,3-dimethylquinoxalin-6-yl)-N',N'-dimethylpropane-1,3-diamine

N-(5,8-dimethoxy-2,3-dimethylquinoxalin-6-yl)-N',N'-dimethylpropane-1,3-diamine (PubChem CID 547620) has the molecular formula C17H26N4O2 and a molecular weight of 318.42 g/mol. Its IUPAC name is N-(5,8-dimethoxy-2,3-dimethylquinoxalin-6-yl)-N',N'-dimethylpropane-1,3-diamine.

Molecular Properties

Compound NameN-(5,8-dimethoxy-2,3-dimethylquinoxalin-6-yl)-N',N'-dimethylpropane-1,3-diamine
PubChem CID547620
Molecular FormulaC17H26N4O2
Molecular Weight318.42 g/mol
Exact Mass318.21
IUPAC NameN-(5,8-dimethoxy-2,3-dimethylquinoxalin-6-yl)-N',N'-dimethylpropane-1,3-diamine
SMILESCOc1cc(NCCCN(C)C)c(OC)c2nc(C)c(C)nc12
InChIInChI=1S/C17H26N4O2/c1-11-12(2)20-16-15(19-11)14(22-5)10-13(17(16)23-6)18-8-7-9-21(3)4/h10,18H,7-9H2,1-6H3
InChIKeyLOXJXRLWVPZMAF-UHFFFAOYSA-N
XLogP2.63
TPSA59.51 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.42
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

Analyze N-(5,8-dimethoxy-2,3-dimethylquinoxalin-6-yl)-N',N'-dimethylpropane-1,3-diamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Acetamide, N-(5,8-dimethoxy-6-quinoxalinyl)-
CID 41861
5-Quinoxalinamine, 6-methoxy-2,3-dimethyl-
CID 122603
Quinoxaline, 2,3-dibenzyl-5,8-dimethoxy-6-((2-(dimethylamino)ethyl)-
CID 547513
Quinoxaline, 5,8-dimethoxy-6-((2-(dimethylamino)ethyl)amino)-2,3-dimethyl-
CID 547586
Quinoxaline, 5,8-dimethoxy-6-((2-(dimethylamino)ethyl)amino)-
CID 547598
Quinoxaline, 2,3-bis(4-chlorophenyl)-5,8-dimethoxy-6-((2-(dimethylamino)ethyl)-
CID 547654
Quinoxaline, 5,8-dimethoxy-6-((3-(dimethylamino)propyl)amino)-2,3-diphenyl-
CID 547663
Quinoxaline, 6-amino-5, 8-dimethoxy-2,3-dimethyl-
CID 612836
Cambridge id 5316088
CID 794487
1,4-Dimethoxyphenazine
CID 291622
5-Methoxy-2,3-dimethylquinoxaline
CID 12541809
2,7-Diamino-3,8-dimethoxyphenazine
CID 147856

Frequently Asked Questions

What is the IUPAC name of N-(5,8-dimethoxy-2,3-dimethylquinoxalin-6-yl)-N',N'-dimethylpropane-1,3-diamine?
The IUPAC name of N-(5,8-dimethoxy-2,3-dimethylquinoxalin-6-yl)-N',N'-dimethylpropane-1,3-diamine (CID 547620) is N-(5,8-dimethoxy-2,3-dimethylquinoxalin-6-yl)-N',N'-dimethylpropane-1,3-diamine.
What is the SMILES notation for N-(5,8-dimethoxy-2,3-dimethylquinoxalin-6-yl)-N',N'-dimethylpropane-1,3-diamine?
The canonical SMILES for N-(5,8-dimethoxy-2,3-dimethylquinoxalin-6-yl)-N',N'-dimethylpropane-1,3-diamine is COc1cc(NCCCN(C)C)c(OC)c2nc(C)c(C)nc12.
What is the InChIKey of N-(5,8-dimethoxy-2,3-dimethylquinoxalin-6-yl)-N',N'-dimethylpropane-1,3-diamine?
The InChIKey is LOXJXRLWVPZMAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N4O2/c1-11-12(2)20-16-15(19-11)14(22-5)10-13(17(16)23-6)18-8-7-9-21(3)4/h10,18H,7-9H2,1-6H3.
What are the key properties of N-(5,8-dimethoxy-2,3-dimethylquinoxalin-6-yl)-N',N'-dimethylpropane-1,3-diamine?
N-(5,8-dimethoxy-2,3-dimethylquinoxalin-6-yl)-N',N'-dimethylpropane-1,3-diamine has a molecular weight of 318.42 g/mol, XLogP of 2.63, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5,8-dimethoxy-2,3-dimethylquinoxalin-6-yl)-N',N'-dimethylpropane-1,3-diamine is sourced from PubChem (CID 547620), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).