N-(2-amino-2-oxoethyl)-4-[4-(2-methylpropylamino)imidazo[1,2-a]quinoxalin-1-yl]benzamide

C23H24N6O2 — CID 68763605

IUPACN-(2-amino-2-oxoethyl)-4-[4-(2-methylpropylamino)imidazo[1,2-a]quinoxalin-1-yl]benzamide
SMILESCC(C)CNc1nc2ccccc2n2c(-c3ccc(C(=O)NCC(N)=O)cc3)cnc12
InChIInChI=1S/C23H24N6O2/c1-14(2)11-25-21-22-26-12-19(29(22)18-6-4-3-5-17(18)28-21)15-7-9-16(10-8-15)23(31)27-13-20(24)30/h3-10,12,14H,11,13H2,1-2H3,(H2,24,30)(H,25,28)(H,27,31)
InChIKeyGAMCHLZXZUNKHI-UHFFFAOYSA-N
MW416.49 g/mol
LogP2.83
Rot. Bonds7

About N-(2-amino-2-oxoethyl)-4-[4-(2-methylpropylamino)imidazo[1,2-a]quinoxalin-1-yl]benzamide

N-(2-amino-2-oxoethyl)-4-[4-(2-methylpropylamino)imidazo[1,2-a]quinoxalin-1-yl]benzamide (PubChem CID 68763605) has the molecular formula C23H24N6O2 and a molecular weight of 416.49 g/mol. Its IUPAC name is N-(2-amino-2-oxoethyl)-4-[4-(2-methylpropylamino)imidazo[1,2-a]quinoxalin-1-yl]benzamide.

Molecular Properties

Compound NameN-(2-amino-2-oxoethyl)-4-[4-(2-methylpropylamino)imidazo[1,2-a]quinoxalin-1-yl]benzamide
PubChem CID68763605
Molecular FormulaC23H24N6O2
Molecular Weight416.49 g/mol
Exact Mass416.20
IUPAC NameN-(2-amino-2-oxoethyl)-4-[4-(2-methylpropylamino)imidazo[1,2-a]quinoxalin-1-yl]benzamide
SMILESCC(C)CNc1nc2ccccc2n2c(-c3ccc(C(=O)NCC(N)=O)cc3)cnc12
InChIInChI=1S/C23H24N6O2/c1-14(2)11-25-21-22-26-12-19(29(22)18-6-4-3-5-17(18)28-21)15-7-9-16(10-8-15)23(31)27-13-20(24)30/h3-10,12,14H,11,13H2,1-2H3,(H2,24,30)(H,25,28)(H,27,31)
InChIKeyGAMCHLZXZUNKHI-UHFFFAOYSA-N
XLogP2.83
TPSA114.41 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500416.49
LogP ≤ 52.83
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Related Compounds

4-[4-[4-(2-methylpropylamino)imidazo[1,2-a]quinoxalin-1-yl]phenyl]-4-oxobutanamide
CID 161066976
N-(2-methylpropyl)-1-pyridin-4-ylimidazo[1,2-a]quinoxalin-4-amine
CID 66601348
N-[cyclopropyl(pyridin-2-yl)methyl]-4-[4-(2-methylpropylamino)imidazo[1,2-a]quinoxalin-1-yl]benzamide
CID 163530972
N-[[3-[4-(2-methylpropylamino)imidazo[1,2-a]quinoxalin-1-yl]phenyl]methyl]acetamide
CID 66601608
2-ethyl-N-[3-[[4-[4-(2-methylpropylamino)imidazo[1,2-a]quinoxalin-1-yl]benzoyl]amino]phenyl]pyrazole-3-carboxamide
CID 66601330
N-(2-methylpropyl)-1-(6-methyl-3-pyridinyl)imidazo[1,2-a]quinoxalin-4-amine;N-(2-methylpropyl)-1-(5-methylthiophen-2-yl)imidazo[1,2-a]quinoxalin-4-amine
CID 159532001
1-(4-methoxy-2-methylphenyl)-N-(2-methylpropyl)imidazo[1,2-a]quinoxalin-4-amine
CID 66601356
2-cyclopropyl-1-[4-[4-[3-(dimethylamino)propylamino]imidazo[1,2-a]quinoxalin-1-yl]phenyl]ethanone
CID 147534440
2-methylpropyl 2-[[1-(3,4-dimethoxyphenyl)imidazo[1,2-a]quinoxalin-4-yl]amino]-4-methylpentanoate
CID 134184515
2-cyclopropyl-1-[4-[4-[(2-fluorophenyl)methylamino]imidazo[1,2-a]quinoxalin-1-yl]phenyl]ethanone
CID 160776843
N-cyclopropyl-4-[4-(2,3-dihydroxypropylamino)-7,8-dimethylimidazo[1,2-a]quinoxalin-1-yl]benzamide
CID 68761182
N-cyclopropyl-4-[6-[2-(hydroxymethyl)phenyl]-8-(2-methylpropylamino)imidazo[1,2-a]pyrazin-3-yl]benzamide
CID 67976869

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-2-oxoethyl)-4-[4-(2-methylpropylamino)imidazo[1,2-a]quinoxalin-1-yl]benzamide?
The IUPAC name of N-(2-amino-2-oxoethyl)-4-[4-(2-methylpropylamino)imidazo[1,2-a]quinoxalin-1-yl]benzamide (CID 68763605) is N-(2-amino-2-oxoethyl)-4-[4-(2-methylpropylamino)imidazo[1,2-a]quinoxalin-1-yl]benzamide.
What is the SMILES notation for N-(2-amino-2-oxoethyl)-4-[4-(2-methylpropylamino)imidazo[1,2-a]quinoxalin-1-yl]benzamide?
The canonical SMILES for N-(2-amino-2-oxoethyl)-4-[4-(2-methylpropylamino)imidazo[1,2-a]quinoxalin-1-yl]benzamide is CC(C)CNc1nc2ccccc2n2c(-c3ccc(C(=O)NCC(N)=O)cc3)cnc12.
What is the InChIKey of N-(2-amino-2-oxoethyl)-4-[4-(2-methylpropylamino)imidazo[1,2-a]quinoxalin-1-yl]benzamide?
The InChIKey is GAMCHLZXZUNKHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N6O2/c1-14(2)11-25-21-22-26-12-19(29(22)18-6-4-3-5-17(18)28-21)15-7-9-16(10-8-15)23(31)27-13-20(24)30/h3-10,12,14H,11,13H2,1-2H3,(H2,24,30)(H,25,28)(H,27,31).
What are the key properties of N-(2-amino-2-oxoethyl)-4-[4-(2-methylpropylamino)imidazo[1,2-a]quinoxalin-1-yl]benzamide?
N-(2-amino-2-oxoethyl)-4-[4-(2-methylpropylamino)imidazo[1,2-a]quinoxalin-1-yl]benzamide has a molecular weight of 416.49 g/mol, XLogP of 2.83, 7 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-2-oxoethyl)-4-[4-(2-methylpropylamino)imidazo[1,2-a]quinoxalin-1-yl]benzamide is sourced from PubChem (CID 68763605), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).