N,N-dimethyl-4-[[[2-(2-oxoquinoxalin-1-yl)acetyl]amino]methyl]benzamide

C20H20N4O3 — CID 134039211

IUPACN,N-dimethyl-4-[[[2-(2-oxoquinoxalin-1-yl)acetyl]amino]methyl]benzamide
SMILESCN(C)C(=O)c1ccc(CNC(=O)Cn2c(=O)cnc3ccccc32)cc1
InChIInChI=1S/C20H20N4O3/c1-23(2)20(27)15-9-7-14(8-10-15)11-22-18(25)13-24-17-6-4-3-5-16(17)21-12-19(24)26/h3-10,12H,11,13H2,1-2H3,(H,22,25)
InChIKeyUDERJFVEFQGXCL-UHFFFAOYSA-N
MW364.41 g/mol
LogP1.41
Rot. Bonds5

About N,N-dimethyl-4-[[[2-(2-oxoquinoxalin-1-yl)acetyl]amino]methyl]benzamide

N,N-dimethyl-4-[[[2-(2-oxoquinoxalin-1-yl)acetyl]amino]methyl]benzamide (PubChem CID 134039211) has the molecular formula C20H20N4O3 and a molecular weight of 364.41 g/mol. Its IUPAC name is N,N-dimethyl-4-[[[2-(2-oxoquinoxalin-1-yl)acetyl]amino]methyl]benzamide.

Molecular Properties

Compound NameN,N-dimethyl-4-[[[2-(2-oxoquinoxalin-1-yl)acetyl]amino]methyl]benzamide
PubChem CID134039211
Molecular FormulaC20H20N4O3
Molecular Weight364.41 g/mol
Exact Mass364.15
IUPAC NameN,N-dimethyl-4-[[[2-(2-oxoquinoxalin-1-yl)acetyl]amino]methyl]benzamide
SMILESCN(C)C(=O)c1ccc(CNC(=O)Cn2c(=O)cnc3ccccc32)cc1
InChIInChI=1S/C20H20N4O3/c1-23(2)20(27)15-9-7-14(8-10-15)11-22-18(25)13-24-17-6-4-3-5-16(17)21-12-19(24)26/h3-10,12H,11,13H2,1-2H3,(H,22,25)
InChIKeyUDERJFVEFQGXCL-UHFFFAOYSA-N
XLogP1.41
TPSA84.30 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.41
LogP ≤ 51.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[[4-(diethylaminomethyl)phenyl]methyl]-2-(2-oxoquinoxalin-1-yl)acetamide
CID 27332914
2-(2-oxoquinoxalin-1-yl)-N-[[4-(piperidin-1-ylmethyl)phenyl]methyl]acetamide
CID 27168668
N-[[4-[(3,5-dimethylpiperidin-1-yl)methyl]phenyl]methyl]-2-(2-oxoquinoxalin-1-yl)acetamide
CID 55845388
2-(2-oxoquinoxalin-1-yl)-N-[(4-pyrrolidin-1-ylsulfonylphenyl)methyl]acetamide
CID 55737221
N,N-dimethyl-4-[[[2-(2-oxo-1,3-benzoxazol-3-yl)acetyl]amino]methyl]benzamide
CID 134039189
N-ethyl-N-[2-[(4-fluorophenyl)methylamino]-2-oxoethyl]-2-(2-oxoquinoxalin-1-yl)acetamide
CID 9321843
1-benzyl-3-[[2-(2-oxoquinoxalin-1-yl)acetyl]amino]thiourea
CID 18271624
2-(2-oxoquinoxalin-1-yl)-N-pentylacetamide
CID 31482684
2-(2-oxoquinoxalin-1-yl)-N-[4-[[2-(2-oxoquinoxalin-1-yl)acetyl]amino]phenyl]acetamide
CID 166181883
N-(3-ethyl-2-hydroxypentyl)-2-(2-oxoquinoxalin-1-yl)acetamide
CID 111115882
2-(2-oxoquinoxalin-1-yl)-N-phenylacetamide
CID 4805436
methyl 4-[[2-(2-oxoquinoxalin-1-yl)acetyl]amino]benzoate
CID 26098218

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-4-[[[2-(2-oxoquinoxalin-1-yl)acetyl]amino]methyl]benzamide?
The IUPAC name of N,N-dimethyl-4-[[[2-(2-oxoquinoxalin-1-yl)acetyl]amino]methyl]benzamide (CID 134039211) is N,N-dimethyl-4-[[[2-(2-oxoquinoxalin-1-yl)acetyl]amino]methyl]benzamide.
What is the SMILES notation for N,N-dimethyl-4-[[[2-(2-oxoquinoxalin-1-yl)acetyl]amino]methyl]benzamide?
The canonical SMILES for N,N-dimethyl-4-[[[2-(2-oxoquinoxalin-1-yl)acetyl]amino]methyl]benzamide is CN(C)C(=O)c1ccc(CNC(=O)Cn2c(=O)cnc3ccccc32)cc1.
What is the InChIKey of N,N-dimethyl-4-[[[2-(2-oxoquinoxalin-1-yl)acetyl]amino]methyl]benzamide?
The InChIKey is UDERJFVEFQGXCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N4O3/c1-23(2)20(27)15-9-7-14(8-10-15)11-22-18(25)13-24-17-6-4-3-5-16(17)21-12-19(24)26/h3-10,12H,11,13H2,1-2H3,(H,22,25).
What are the key properties of N,N-dimethyl-4-[[[2-(2-oxoquinoxalin-1-yl)acetyl]amino]methyl]benzamide?
N,N-dimethyl-4-[[[2-(2-oxoquinoxalin-1-yl)acetyl]amino]methyl]benzamide has a molecular weight of 364.41 g/mol, XLogP of 1.41, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-4-[[[2-(2-oxoquinoxalin-1-yl)acetyl]amino]methyl]benzamide is sourced from PubChem (CID 134039211), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).