2-amino-1-(4-ethyl-2,3-dihydroquinoxalin-1-yl)propan-1-one

C13H19N3O — CID 83631875

IUPAC2-amino-1-(4-ethyl-2,3-dihydroquinoxalin-1-yl)propan-1-one
SMILESCCN1CCN(C(=O)C(C)N)c2ccccc21
InChIInChI=1S/C13H19N3O/c1-3-15-8-9-16(13(17)10(2)14)12-7-5-4-6-11(12)15/h4-7,10H,3,8-9,14H2,1-2H3
InChIKeyRBUMEXAEMHWUKF-UHFFFAOYSA-N
MW233.32 g/mol
LogP1.21
Rot. Bonds2

About 2-amino-1-(4-ethyl-2,3-dihydroquinoxalin-1-yl)propan-1-one

2-amino-1-(4-ethyl-2,3-dihydroquinoxalin-1-yl)propan-1-one (PubChem CID 83631875) has the molecular formula C13H19N3O and a molecular weight of 233.32 g/mol. Its IUPAC name is 2-amino-1-(4-ethyl-2,3-dihydroquinoxalin-1-yl)propan-1-one.

Molecular Properties

Compound Name2-amino-1-(4-ethyl-2,3-dihydroquinoxalin-1-yl)propan-1-one
PubChem CID83631875
Molecular FormulaC13H19N3O
Molecular Weight233.32 g/mol
Exact Mass233.15
IUPAC Name2-amino-1-(4-ethyl-2,3-dihydroquinoxalin-1-yl)propan-1-one
SMILESCCN1CCN(C(=O)C(C)N)c2ccccc21
InChIInChI=1S/C13H19N3O/c1-3-15-8-9-16(13(17)10(2)14)12-7-5-4-6-11(12)15/h4-7,10H,3,8-9,14H2,1-2H3
InChIKeyRBUMEXAEMHWUKF-UHFFFAOYSA-N
XLogP1.21
TPSA49.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.32
LogP ≤ 51.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-amino-1-(4-ethyl-2,3-dihydroquinoxalin-1-yl)propan-1-one 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

2-amino-1-(1-benzyl-3,4-dihydro-2H-1,5-benzodiazepin-5-yl)propan-1-one
CID 119891407
2-amino-1-(2,3-dihydroindol-1-yl)propan-1-one
CID 20806588
2-(4-aminophenyl)-1-(4-ethyl-2,3-dihydroquinoxalin-1-yl)ethanone;dihydrochloride
CID 119883791
2-amino-1-[4-(cyclopropylmethyl)-2,3-dihydroquinoxalin-1-yl]pentan-1-one;dihydrochloride
CID 119895842
(3-aminocyclopentyl)-(4-ethyl-2,3-dihydroquinoxalin-1-yl)methanone
CID 119883802
3-amino-1-[4-(cyclopropylmethyl)-2,3-dihydroquinoxalin-1-yl]-2-methyl-3-phenylpropan-1-one
CID 119895849
(5-amino-2-methylphenyl)-(4-ethyl-2,3-dihydroquinoxalin-1-yl)methanone;dihydrochloride
CID 120646664
(2S)-2-amino-1-(2,3,4,5-tetrahydro-1-benzazepin-1-yl)propan-1-one;hydrochloride
CID 119294288
1-(4-ethyl-2,3-dihydroquinoxalin-1-yl)-4-(methylamino)butan-1-one
CID 119883796
1-(4-ethyl-2,3-dihydroquinoxalin-1-yl)-4-(methylamino)butan-1-one;dihydrochloride
CID 119883795
[1-[4-(cyclopropylmethyl)-2,3-dihydroquinoxalin-1-yl]-1-oxopropan-2-yl]urea
CID 71868713
6-amino-2-methyl-1-(4-methyl-2,3-dihydroquinoxalin-1-yl)heptan-1-one
CID 65291095

Frequently Asked Questions

What is the IUPAC name of 2-amino-1-(4-ethyl-2,3-dihydroquinoxalin-1-yl)propan-1-one?
The IUPAC name of 2-amino-1-(4-ethyl-2,3-dihydroquinoxalin-1-yl)propan-1-one (CID 83631875) is 2-amino-1-(4-ethyl-2,3-dihydroquinoxalin-1-yl)propan-1-one.
What is the SMILES notation for 2-amino-1-(4-ethyl-2,3-dihydroquinoxalin-1-yl)propan-1-one?
The canonical SMILES for 2-amino-1-(4-ethyl-2,3-dihydroquinoxalin-1-yl)propan-1-one is CCN1CCN(C(=O)C(C)N)c2ccccc21.
What is the InChIKey of 2-amino-1-(4-ethyl-2,3-dihydroquinoxalin-1-yl)propan-1-one?
The InChIKey is RBUMEXAEMHWUKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O/c1-3-15-8-9-16(13(17)10(2)14)12-7-5-4-6-11(12)15/h4-7,10H,3,8-9,14H2,1-2H3.
What are the key properties of 2-amino-1-(4-ethyl-2,3-dihydroquinoxalin-1-yl)propan-1-one?
2-amino-1-(4-ethyl-2,3-dihydroquinoxalin-1-yl)propan-1-one has a molecular weight of 233.32 g/mol, XLogP of 1.21, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-1-(4-ethyl-2,3-dihydroquinoxalin-1-yl)propan-1-one is sourced from PubChem (CID 83631875), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).