N-(2-tert-butylphenyl)-2-(2-oxoquinoxalin-1-yl)acetamide

C20H21N3O2 — CID 2517094

IUPACN-(2-tert-butylphenyl)-2-(2-oxoquinoxalin-1-yl)acetamide
SMILESCC(C)(C)c1ccccc1NC(=O)Cn1c(=O)cnc2ccccc21
InChIInChI=1S/C20H21N3O2/c1-20(2,3)14-8-4-5-9-15(14)22-18(24)13-23-17-11-7-6-10-16(17)21-12-19(23)25/h4-12H,13H2,1-3H3,(H,22,24)
InChIKeyRWXIVLULWDQBMJ-UHFFFAOYSA-N
MW335.41 g/mol
LogP3.33
Rot. Bonds3

About N-(2-tert-butylphenyl)-2-(2-oxoquinoxalin-1-yl)acetamide

N-(2-tert-butylphenyl)-2-(2-oxoquinoxalin-1-yl)acetamide (PubChem CID 2517094) has the molecular formula C20H21N3O2 and a molecular weight of 335.41 g/mol. Its IUPAC name is N-(2-tert-butylphenyl)-2-(2-oxoquinoxalin-1-yl)acetamide.

Molecular Properties

Compound NameN-(2-tert-butylphenyl)-2-(2-oxoquinoxalin-1-yl)acetamide
PubChem CID2517094
Molecular FormulaC20H21N3O2
Molecular Weight335.41 g/mol
Exact Mass335.16
IUPAC NameN-(2-tert-butylphenyl)-2-(2-oxoquinoxalin-1-yl)acetamide
SMILESCC(C)(C)c1ccccc1NC(=O)Cn1c(=O)cnc2ccccc21
InChIInChI=1S/C20H21N3O2/c1-20(2,3)14-8-4-5-9-15(14)22-18(24)13-23-17-11-7-6-10-16(17)21-12-19(23)25/h4-12H,13H2,1-3H3,(H,22,24)
InChIKeyRWXIVLULWDQBMJ-UHFFFAOYSA-N
XLogP3.33
TPSA63.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.41
LogP ≤ 53.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(2-tert-butylphenyl)-2-(2-oxoquinoxalin-1-yl)acetamide?
The IUPAC name of N-(2-tert-butylphenyl)-2-(2-oxoquinoxalin-1-yl)acetamide (CID 2517094) is N-(2-tert-butylphenyl)-2-(2-oxoquinoxalin-1-yl)acetamide.
What is the SMILES notation for N-(2-tert-butylphenyl)-2-(2-oxoquinoxalin-1-yl)acetamide?
The canonical SMILES for N-(2-tert-butylphenyl)-2-(2-oxoquinoxalin-1-yl)acetamide is CC(C)(C)c1ccccc1NC(=O)Cn1c(=O)cnc2ccccc21.
What is the InChIKey of N-(2-tert-butylphenyl)-2-(2-oxoquinoxalin-1-yl)acetamide?
The InChIKey is RWXIVLULWDQBMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21N3O2/c1-20(2,3)14-8-4-5-9-15(14)22-18(24)13-23-17-11-7-6-10-16(17)21-12-19(23)25/h4-12H,13H2,1-3H3,(H,22,24).
What are the key properties of N-(2-tert-butylphenyl)-2-(2-oxoquinoxalin-1-yl)acetamide?
N-(2-tert-butylphenyl)-2-(2-oxoquinoxalin-1-yl)acetamide has a molecular weight of 335.41 g/mol, XLogP of 3.33, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-tert-butylphenyl)-2-(2-oxoquinoxalin-1-yl)acetamide is sourced from PubChem (CID 2517094), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).