5-methoxy-4-methyl-2-propan-2-yl-2,3-dihydro-1H-quinoxaline

C13H20N2O — CID 84623746

IUPAC5-methoxy-4-methyl-2-propan-2-yl-2,3-dihydro-1H-quinoxaline
SMILESCOc1cccc2c1N(C)CC(C(C)C)N2
InChIInChI=1S/C13H20N2O/c1-9(2)11-8-15(3)13-10(14-11)6-5-7-12(13)16-4/h5-7,9,11,14H,8H2,1-4H3
InChIKeyRNRJIXBHWCWRGP-UHFFFAOYSA-N
MW220.32 g/mol
LogP2.58
Rot. Bonds2

About 5-methoxy-4-methyl-2-propan-2-yl-2,3-dihydro-1H-quinoxaline

5-methoxy-4-methyl-2-propan-2-yl-2,3-dihydro-1H-quinoxaline (PubChem CID 84623746) has the molecular formula C13H20N2O and a molecular weight of 220.32 g/mol. Its IUPAC name is 5-methoxy-4-methyl-2-propan-2-yl-2,3-dihydro-1H-quinoxaline.

Molecular Properties

Compound Name5-methoxy-4-methyl-2-propan-2-yl-2,3-dihydro-1H-quinoxaline
PubChem CID84623746
Molecular FormulaC13H20N2O
Molecular Weight220.32 g/mol
Exact Mass220.16
IUPAC Name5-methoxy-4-methyl-2-propan-2-yl-2,3-dihydro-1H-quinoxaline
SMILESCOc1cccc2c1N(C)CC(C(C)C)N2
InChIInChI=1S/C13H20N2O/c1-9(2)11-8-15(3)13-10(14-11)6-5-7-12(13)16-4/h5-7,9,11,14H,8H2,1-4H3
InChIKeyRNRJIXBHWCWRGP-UHFFFAOYSA-N
XLogP2.58
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.32
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

8-methoxy-4-methyl-2-propan-2-yl-2,3-dihydro-1H-quinoxaline
CID 84623745
5-methoxy-4-methyl-3-propan-2-yl-2,3-dihydro-1H-quinoxaline
CID 84623748
6,7-dimethoxy-2-propan-2-yl-1,2,3,4-tetrahydroquinoxaline
CID 83008630
9-methoxy-1,2,3,3a,4,5-hexahydropyrrolo[1,2-a]quinoxaline
CID 84620310
6-methoxy-5-methylspiro[2,4-dihydro-1H-1,5-benzodiazepine-3,1'-cyclobutane]
CID 115099270
5-methoxy-4-methylspiro[1,2-dihydroquinoxaline-3,1'-cyclobutane]
CID 115097269
3-ethyl-5-methoxy-4-methyl-2,3-dihydro-1H-quinoxaline
CID 84620814
8-methoxy-1-methyl-3,4-dihydro-2H-quinolin-4-amine
CID 23008911
1-methyl-3-propan-2-yl-3,4-dihydro-2H-quinoxaline-6-carbonitrile
CID 84622146
5-methoxy-4-methylspiro[1,2-dihydroquinoxaline-3,1'-cyclohexane]
CID 115097947
1-(4-methoxy-1-methyl-2,3-dihydroindol-3-yl)ethanol
CID 117200379
4-bromo-5-methoxy-2-propan-2-yl-2,3-dihydro-1H-indole
CID 84712663

Frequently Asked Questions

What is the IUPAC name of 5-methoxy-4-methyl-2-propan-2-yl-2,3-dihydro-1H-quinoxaline?
The IUPAC name of 5-methoxy-4-methyl-2-propan-2-yl-2,3-dihydro-1H-quinoxaline (CID 84623746) is 5-methoxy-4-methyl-2-propan-2-yl-2,3-dihydro-1H-quinoxaline.
What is the SMILES notation for 5-methoxy-4-methyl-2-propan-2-yl-2,3-dihydro-1H-quinoxaline?
The canonical SMILES for 5-methoxy-4-methyl-2-propan-2-yl-2,3-dihydro-1H-quinoxaline is COc1cccc2c1N(C)CC(C(C)C)N2.
What is the InChIKey of 5-methoxy-4-methyl-2-propan-2-yl-2,3-dihydro-1H-quinoxaline?
The InChIKey is RNRJIXBHWCWRGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O/c1-9(2)11-8-15(3)13-10(14-11)6-5-7-12(13)16-4/h5-7,9,11,14H,8H2,1-4H3.
What are the key properties of 5-methoxy-4-methyl-2-propan-2-yl-2,3-dihydro-1H-quinoxaline?
5-methoxy-4-methyl-2-propan-2-yl-2,3-dihydro-1H-quinoxaline has a molecular weight of 220.32 g/mol, XLogP of 2.58, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-4-methyl-2-propan-2-yl-2,3-dihydro-1H-quinoxaline is sourced from PubChem (CID 84623746), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).