2-(4-methyl-2,3-dihydroquinoxalin-1-yl)ethanamine

C11H17N3 — CID 28806962

IUPAC2-(4-methyl-2,3-dihydroquinoxalin-1-yl)ethanamine
SMILESCN1CCN(CCN)c2ccccc21
InChIInChI=1S/C11H17N3/c1-13-8-9-14(7-6-12)11-5-3-2-4-10(11)13/h2-5H,6-9,12H2,1H3
InChIKeyKGWQEULCNOWXNC-UHFFFAOYSA-N
MW191.28 g/mol
LogP0.90
Rot. Bonds2

About 2-(4-methyl-2,3-dihydroquinoxalin-1-yl)ethanamine

2-(4-methyl-2,3-dihydroquinoxalin-1-yl)ethanamine (PubChem CID 28806962) has the molecular formula C11H17N3 and a molecular weight of 191.28 g/mol. Its IUPAC name is 2-(4-methyl-2,3-dihydroquinoxalin-1-yl)ethanamine.

Molecular Properties

Compound Name2-(4-methyl-2,3-dihydroquinoxalin-1-yl)ethanamine
PubChem CID28806962
Molecular FormulaC11H17N3
Molecular Weight191.28 g/mol
Exact Mass191.14
IUPAC Name2-(4-methyl-2,3-dihydroquinoxalin-1-yl)ethanamine
SMILESCN1CCN(CCN)c2ccccc21
InChIInChI=1S/C11H17N3/c1-13-8-9-14(7-6-12)11-5-3-2-4-10(11)13/h2-5H,6-9,12H2,1H3
InChIKeyKGWQEULCNOWXNC-UHFFFAOYSA-N
XLogP0.90
TPSA32.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.28
LogP ≤ 50.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(4-methyl-2,3-dihydroquinoxalin-1-yl)ethanamine?
The IUPAC name of 2-(4-methyl-2,3-dihydroquinoxalin-1-yl)ethanamine (CID 28806962) is 2-(4-methyl-2,3-dihydroquinoxalin-1-yl)ethanamine.
What is the SMILES notation for 2-(4-methyl-2,3-dihydroquinoxalin-1-yl)ethanamine?
The canonical SMILES for 2-(4-methyl-2,3-dihydroquinoxalin-1-yl)ethanamine is CN1CCN(CCN)c2ccccc21.
What is the InChIKey of 2-(4-methyl-2,3-dihydroquinoxalin-1-yl)ethanamine?
The InChIKey is KGWQEULCNOWXNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3/c1-13-8-9-14(7-6-12)11-5-3-2-4-10(11)13/h2-5H,6-9,12H2,1H3.
What are the key properties of 2-(4-methyl-2,3-dihydroquinoxalin-1-yl)ethanamine?
2-(4-methyl-2,3-dihydroquinoxalin-1-yl)ethanamine has a molecular weight of 191.28 g/mol, XLogP of 0.90, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methyl-2,3-dihydroquinoxalin-1-yl)ethanamine is sourced from PubChem (CID 28806962), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).