N-(2-ethyl-6-methylphenyl)-2-(3-morpholin-4-ylquinoxalin-2-yl)sulfanylacetamide

C23H26N4O2S — CID 15991458

IUPACN-(2-ethyl-6-methylphenyl)-2-(3-morpholin-4-ylquinoxalin-2-yl)sulfanylacetamide
SMILESCCc1cccc(C)c1NC(=O)CSc1nc2ccccc2nc1N1CCOCC1
InChIInChI=1S/C23H26N4O2S/c1-3-17-8-6-7-16(2)21(17)26-20(28)15-30-23-22(27-11-13-29-14-12-27)24-18-9-4-5-10-19(18)25-23/h4-10H,3,11-15H2,1-2H3,(H,26,28)
InChIKeyOUBUSNRNFXCSGV-UHFFFAOYSA-N
MW422.55 g/mol
LogP4.07
Rot. Bonds6

About N-(2-ethyl-6-methylphenyl)-2-(3-morpholin-4-ylquinoxalin-2-yl)sulfanylacetamide

N-(2-ethyl-6-methylphenyl)-2-(3-morpholin-4-ylquinoxalin-2-yl)sulfanylacetamide (PubChem CID 15991458) has the molecular formula C23H26N4O2S and a molecular weight of 422.55 g/mol. Its IUPAC name is N-(2-ethyl-6-methylphenyl)-2-(3-morpholin-4-ylquinoxalin-2-yl)sulfanylacetamide.

Molecular Properties

Compound NameN-(2-ethyl-6-methylphenyl)-2-(3-morpholin-4-ylquinoxalin-2-yl)sulfanylacetamide
PubChem CID15991458
Molecular FormulaC23H26N4O2S
Molecular Weight422.55 g/mol
Exact Mass422.18
IUPAC NameN-(2-ethyl-6-methylphenyl)-2-(3-morpholin-4-ylquinoxalin-2-yl)sulfanylacetamide
SMILESCCc1cccc(C)c1NC(=O)CSc1nc2ccccc2nc1N1CCOCC1
InChIInChI=1S/C23H26N4O2S/c1-3-17-8-6-7-16(2)21(17)26-20(28)15-30-23-22(27-11-13-29-14-12-27)24-18-9-4-5-10-19(18)25-23/h4-10H,3,11-15H2,1-2H3,(H,26,28)
InChIKeyOUBUSNRNFXCSGV-UHFFFAOYSA-N
XLogP4.07
TPSA67.35 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500422.55
LogP ≤ 54.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-(2-ethyl-6-methylphenyl)-2-(3-morpholin-4-ylquinoxalin-2-yl)sulfanylacetamide 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

3-benzyl-N-(2-morpholinoethyl)quinoxalin-2-amine
CID 11624425
2-(2-tert-Butyl-quinazolin-4-ylsulfanyl)-N-(4-morpholin-4-yl-phenyl)-acetamide
CID 1442464
N-(4-Morpholin-4-yl-phenyl)-2-(2-propyl-quinazolin-4-ylsulfanyl)-acetamide
CID 1442655
2-(3-Cyano-6-methyl-quinolin-2-ylsulfanyl)-N-(2-morpholin-4-yl-phenyl)-acetamide
CID 3207505
2-(3-Cyano-6-ethyl-quinolin-2-ylsulfanyl)-N-(2-morpholin-4-yl-phenyl)-acetamide
CID 3207568
2-(3-Cyano-8-methyl-quinolin-2-ylsulfanyl)-N-(2-morpholin-4-yl-phenyl)-acetamide
CID 3207678
N-(3-ethylphenyl)-2-((3-(piperidin-1-yl)quinoxalin-2-yl)thio)acetamide
CID 15988512
N-(4-Butylphenyl)-2-{[3-(piperidin-1-YL)quinoxalin-2-YL]sulfanyl}acetamide
CID 15991419
N-(3-Methylphenyl)-2-{[3-(4-methylpiperidin-1-YL)quinoxalin-2-YL]sulfanyl}acetamide
CID 15991424
N-(4-Butylphenyl)-2-{[3-(morpholin-4-YL)quinoxalin-2-YL]sulfanyl}acetamide
CID 15991436
N-[4-(acetylamino)phenyl]-2-{[3-(4-methylpiperidin-1-yl)quinoxalin-2-yl]thio}acetamide
CID 15991457
N-(3-Methylphenyl)-2-{[3-(piperidin-1-YL)quinoxalin-2-YL]sulfanyl}acetamide
CID 16956475

Frequently Asked Questions

What is the IUPAC name of N-(2-ethyl-6-methylphenyl)-2-(3-morpholin-4-ylquinoxalin-2-yl)sulfanylacetamide?
The IUPAC name of N-(2-ethyl-6-methylphenyl)-2-(3-morpholin-4-ylquinoxalin-2-yl)sulfanylacetamide (CID 15991458) is N-(2-ethyl-6-methylphenyl)-2-(3-morpholin-4-ylquinoxalin-2-yl)sulfanylacetamide.
What is the SMILES notation for N-(2-ethyl-6-methylphenyl)-2-(3-morpholin-4-ylquinoxalin-2-yl)sulfanylacetamide?
The canonical SMILES for N-(2-ethyl-6-methylphenyl)-2-(3-morpholin-4-ylquinoxalin-2-yl)sulfanylacetamide is CCc1cccc(C)c1NC(=O)CSc1nc2ccccc2nc1N1CCOCC1.
What is the InChIKey of N-(2-ethyl-6-methylphenyl)-2-(3-morpholin-4-ylquinoxalin-2-yl)sulfanylacetamide?
The InChIKey is OUBUSNRNFXCSGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H26N4O2S/c1-3-17-8-6-7-16(2)21(17)26-20(28)15-30-23-22(27-11-13-29-14-12-27)24-18-9-4-5-10-19(18)25-23/h4-10H,3,11-15H2,1-2H3,(H,26,28).
What are the key properties of N-(2-ethyl-6-methylphenyl)-2-(3-morpholin-4-ylquinoxalin-2-yl)sulfanylacetamide?
N-(2-ethyl-6-methylphenyl)-2-(3-morpholin-4-ylquinoxalin-2-yl)sulfanylacetamide has a molecular weight of 422.55 g/mol, XLogP of 4.07, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethyl-6-methylphenyl)-2-(3-morpholin-4-ylquinoxalin-2-yl)sulfanylacetamide is sourced from PubChem (CID 15991458), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).