6,7-dimethyl-2-pent-4-enoxyquinoxaline

C15H18N2O — CID 24751277

IUPAC6,7-dimethyl-2-pent-4-enoxyquinoxaline
SMILESC=CCCCOc1cnc2cc(C)c(C)cc2n1
InChIInChI=1S/C15H18N2O/c1-4-5-6-7-18-15-10-16-13-8-11(2)12(3)9-14(13)17-15/h4,8-10H,1,5-7H2,2-3H3
InChIKeyQDAOGFUTLNJHJY-UHFFFAOYSA-N
MW242.32 g/mol
LogP3.59
Rot. Bonds5

About 6,7-dimethyl-2-pent-4-enoxyquinoxaline

6,7-dimethyl-2-pent-4-enoxyquinoxaline (PubChem CID 24751277) has the molecular formula C15H18N2O and a molecular weight of 242.32 g/mol. Its IUPAC name is 6,7-dimethyl-2-pent-4-enoxyquinoxaline.

Molecular Properties

Compound Name6,7-dimethyl-2-pent-4-enoxyquinoxaline
PubChem CID24751277
Molecular FormulaC15H18N2O
Molecular Weight242.32 g/mol
Exact Mass242.14
IUPAC Name6,7-dimethyl-2-pent-4-enoxyquinoxaline
SMILESC=CCCCOc1cnc2cc(C)c(C)cc2n1
InChIInChI=1S/C15H18N2O/c1-4-5-6-7-18-15-10-16-13-8-11(2)12(3)9-14(13)17-15/h4,8-10H,1,5-7H2,2-3H3
InChIKeyQDAOGFUTLNJHJY-UHFFFAOYSA-N
XLogP3.59
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.32
LogP ≤ 53.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

6,7-Dimethylquinoxaline
CID 247669
2,3-Dimethoxy-6,7-dimethylquinoxaline
CID 14842752
2-(2,2,2-Trifluoroethoxy)quinoxaline
CID 135043494
2-Methoxyquinoxaline
CID 292499
2-(1-Methylpiperidin-4-yloxy)-8-phenyl-6-(trifluoromethyl)quinoxaline
CID 44581710
6,7-Difluoro-2-[(2-hexyldecyl)oxy]quinoxaline
CID 166594909
2,6,7-Trimethylquinoxaline
CID 22975401
2-[4-[4-(3-Methylphenyl)piperazin-1-yl]butoxy]-5,6,7,8-tetrahydroquinoxaline
CID 44211967
N-(4-ethylphenyl)-2-quinoxalin-2-yloxyacetamide
CID 2478759
2-(4-Fluorophenyl)-5-pentoxypyrazine
CID 14122079
2-Ethoxy-5-(4-fluorophenyl)pyrazine
CID 14122080
2-(4-Fluorophenyl)-5-hexoxypyrazine
CID 14122081

Frequently Asked Questions

What is the IUPAC name of 6,7-dimethyl-2-pent-4-enoxyquinoxaline?
The IUPAC name of 6,7-dimethyl-2-pent-4-enoxyquinoxaline (CID 24751277) is 6,7-dimethyl-2-pent-4-enoxyquinoxaline.
What is the SMILES notation for 6,7-dimethyl-2-pent-4-enoxyquinoxaline?
The canonical SMILES for 6,7-dimethyl-2-pent-4-enoxyquinoxaline is C=CCCCOc1cnc2cc(C)c(C)cc2n1.
What is the InChIKey of 6,7-dimethyl-2-pent-4-enoxyquinoxaline?
The InChIKey is QDAOGFUTLNJHJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O/c1-4-5-6-7-18-15-10-16-13-8-11(2)12(3)9-14(13)17-15/h4,8-10H,1,5-7H2,2-3H3.
What are the key properties of 6,7-dimethyl-2-pent-4-enoxyquinoxaline?
6,7-dimethyl-2-pent-4-enoxyquinoxaline has a molecular weight of 242.32 g/mol, XLogP of 3.59, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6,7-dimethyl-2-pent-4-enoxyquinoxaline is sourced from PubChem (CID 24751277), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).