3-(2-methylpropoxy)quinoxalin-2-amine

C12H15N3O — CID 102987688

IUPAC3-(2-methylpropoxy)quinoxalin-2-amine
SMILESCC(C)COc1nc2ccccc2nc1N
InChIInChI=1S/C12H15N3O/c1-8(2)7-16-12-11(13)14-9-5-3-4-6-10(9)15-12/h3-6,8H,7H2,1-2H3,(H2,13,14)
InChIKeyVJIYVGWIXJEXQA-UHFFFAOYSA-N
MW217.27 g/mol
LogP2.25
Rot. Bonds3

About 3-(2-methylpropoxy)quinoxalin-2-amine

3-(2-methylpropoxy)quinoxalin-2-amine (PubChem CID 102987688) has the molecular formula C12H15N3O and a molecular weight of 217.27 g/mol. Its IUPAC name is 3-(2-methylpropoxy)quinoxalin-2-amine.

Molecular Properties

Compound Name3-(2-methylpropoxy)quinoxalin-2-amine
PubChem CID102987688
Molecular FormulaC12H15N3O
Molecular Weight217.27 g/mol
Exact Mass217.12
IUPAC Name3-(2-methylpropoxy)quinoxalin-2-amine
SMILESCC(C)COc1nc2ccccc2nc1N
InChIInChI=1S/C12H15N3O/c1-8(2)7-16-12-11(13)14-9-5-3-4-6-10(9)15-12/h3-6,8H,7H2,1-2H3,(H2,13,14)
InChIKeyVJIYVGWIXJEXQA-UHFFFAOYSA-N
XLogP2.25
TPSA61.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.27
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-prop-2-ynoxyquinoxalin-2-amine
CID 102987605
5-bromo-3-(2-methylpropoxy)pyrazin-2-amine
CID 46942042
3-[(3-methoxyphenyl)methoxy]quinoxalin-2-amine
CID 102987596
3-[2-(2-methylpropoxy)phenyl]pyridine-2,6-diamine
CID 139370148
3-(3-ethoxyphenoxy)quinoxalin-2-amine
CID 102988134
3-[(1-methylpiperidin-2-yl)methoxy]quinoxalin-2-amine
CID 102988241
2-(2-methylpropoxy)-1,3-benzoxazole
CID 122485672
3-(2-methylbutoxy)quinolin-2-amine
CID 118174550
6-(1,3-dihydroisoindol-2-yl)-2-(2-methylpropoxy)pyridin-3-amine
CID 62205009
5-bromo-4-(2-methylpropoxy)pyrimidin-2-amine
CID 80859676
2-ethyl-6-(2-methylpropoxy)pyrimidine-4,5-diamine
CID 82455747
6-(2-methylpropoxy)-2-(2-methylpropyl)pyrimidine-4,5-diamine
CID 82458321

Frequently Asked Questions

What is the IUPAC name of 3-(2-methylpropoxy)quinoxalin-2-amine?
The IUPAC name of 3-(2-methylpropoxy)quinoxalin-2-amine (CID 102987688) is 3-(2-methylpropoxy)quinoxalin-2-amine.
What is the SMILES notation for 3-(2-methylpropoxy)quinoxalin-2-amine?
The canonical SMILES for 3-(2-methylpropoxy)quinoxalin-2-amine is CC(C)COc1nc2ccccc2nc1N.
What is the InChIKey of 3-(2-methylpropoxy)quinoxalin-2-amine?
The InChIKey is VJIYVGWIXJEXQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N3O/c1-8(2)7-16-12-11(13)14-9-5-3-4-6-10(9)15-12/h3-6,8H,7H2,1-2H3,(H2,13,14).
What are the key properties of 3-(2-methylpropoxy)quinoxalin-2-amine?
3-(2-methylpropoxy)quinoxalin-2-amine has a molecular weight of 217.27 g/mol, XLogP of 2.25, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methylpropoxy)quinoxalin-2-amine is sourced from PubChem (CID 102987688), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).