2-(3-aminopyrazin-2-yl)sulfanyl-N-(2-ethoxyphenyl)acetamide

C14H16N4O2S — CID 106678992

IUPAC2-(3-aminopyrazin-2-yl)sulfanyl-N-(2-ethoxyphenyl)acetamide
SMILESCCOc1ccccc1NC(=O)CSc1nccnc1N
InChIInChI=1S/C14H16N4O2S/c1-2-20-11-6-4-3-5-10(11)18-12(19)9-21-14-13(15)16-7-8-17-14/h3-8H,2,9H2,1H3,(H2,15,16)(H,18,19)
InChIKeyDRMUHFQVCNKZBU-UHFFFAOYSA-N
MW304.38 g/mol
LogP2.19
Rot. Bonds6

About 2-(3-aminopyrazin-2-yl)sulfanyl-N-(2-ethoxyphenyl)acetamide

2-(3-aminopyrazin-2-yl)sulfanyl-N-(2-ethoxyphenyl)acetamide (PubChem CID 106678992) has the molecular formula C14H16N4O2S and a molecular weight of 304.38 g/mol. Its IUPAC name is 2-(3-aminopyrazin-2-yl)sulfanyl-N-(2-ethoxyphenyl)acetamide.

Molecular Properties

Compound Name2-(3-aminopyrazin-2-yl)sulfanyl-N-(2-ethoxyphenyl)acetamide
PubChem CID106678992
Molecular FormulaC14H16N4O2S
Molecular Weight304.38 g/mol
Exact Mass304.10
IUPAC Name2-(3-aminopyrazin-2-yl)sulfanyl-N-(2-ethoxyphenyl)acetamide
SMILESCCOc1ccccc1NC(=O)CSc1nccnc1N
InChIInChI=1S/C14H16N4O2S/c1-2-20-11-6-4-3-5-10(11)18-12(19)9-21-14-13(15)16-7-8-17-14/h3-8H,2,9H2,1H3,(H2,15,16)(H,18,19)
InChIKeyDRMUHFQVCNKZBU-UHFFFAOYSA-N
XLogP2.19
TPSA90.13 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.38
LogP ≤ 52.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

2-[(2-amino-3-pyridinyl)oxy]-N-(2-ethoxyphenyl)acetamide
CID 82055927
2-(4-amino-5-cyanopyrimidin-2-yl)sulfanyl-N-(2-ethoxyphenyl)acetamide
CID 40662535
N-(2-ethoxyphenyl)-2-[3-[4-(2-methoxyphenyl)piperazin-1-yl]pyrazin-2-yl]sulfanylacetamide
CID 46393657
2-(3-aminopyrazin-2-yl)sulfanyl-N-(2,3-dichlorophenyl)acetamide
CID 106678563
N-(2-ethoxyphenyl)-2-[(2-oxo-1H-pyrimidin-6-yl)sulfanyl]acetamide
CID 30595241
2-(2-chlorophenyl)sulfanyl-N-(2-ethoxyphenyl)acetamide
CID 2337984
2-[(4-amino-6-oxo-1H-pyrimidin-2-yl)sulfanyl]-N-(2-ethoxyphenyl)acetamide
CID 135495486
2-[(5-amino-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-ethoxyphenyl)acetamide
CID 134001453
N-(2-ethoxyphenyl)-2-quinoxalin-2-ylsulfanylacetamide
CID 34905335
methyl 3-(2-ethoxyanilino)-3-oxopropanoate
CID 28637956
[2-(2-ethoxyanilino)-2-oxoethyl] 2-[2-(2-ethoxyanilino)-2-oxoethyl]sulfanylbenzoate
CID 3503829
N-(2-ethoxyphenyl)-2-(3,5,7-trimethylquinolin-2-yl)sulfanylacetamide
CID 1169577

Frequently Asked Questions

What is the IUPAC name of 2-(3-aminopyrazin-2-yl)sulfanyl-N-(2-ethoxyphenyl)acetamide?
The IUPAC name of 2-(3-aminopyrazin-2-yl)sulfanyl-N-(2-ethoxyphenyl)acetamide (CID 106678992) is 2-(3-aminopyrazin-2-yl)sulfanyl-N-(2-ethoxyphenyl)acetamide.
What is the SMILES notation for 2-(3-aminopyrazin-2-yl)sulfanyl-N-(2-ethoxyphenyl)acetamide?
The canonical SMILES for 2-(3-aminopyrazin-2-yl)sulfanyl-N-(2-ethoxyphenyl)acetamide is CCOc1ccccc1NC(=O)CSc1nccnc1N.
What is the InChIKey of 2-(3-aminopyrazin-2-yl)sulfanyl-N-(2-ethoxyphenyl)acetamide?
The InChIKey is DRMUHFQVCNKZBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N4O2S/c1-2-20-11-6-4-3-5-10(11)18-12(19)9-21-14-13(15)16-7-8-17-14/h3-8H,2,9H2,1H3,(H2,15,16)(H,18,19).
What are the key properties of 2-(3-aminopyrazin-2-yl)sulfanyl-N-(2-ethoxyphenyl)acetamide?
2-(3-aminopyrazin-2-yl)sulfanyl-N-(2-ethoxyphenyl)acetamide has a molecular weight of 304.38 g/mol, XLogP of 2.19, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-aminopyrazin-2-yl)sulfanyl-N-(2-ethoxyphenyl)acetamide is sourced from PubChem (CID 106678992), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).