2-(4-ethylphenoxy)-N-[4-[(3-methoxypyrazin-2-yl)sulfamoyl]phenyl]propanamide

C22H24N4O5S — CID 54782995

IUPAC2-(4-ethylphenoxy)-N-[4-[(3-methoxypyrazin-2-yl)sulfamoyl]phenyl]propanamide
SMILESCCc1ccc(OC(C)C(=O)Nc2ccc(S(=O)(=O)Nc3nccnc3OC)cc2)cc1
InChIInChI=1S/C22H24N4O5S/c1-4-16-5-9-18(10-6-16)31-15(2)21(27)25-17-7-11-19(12-8-17)32(28,29)26-20-22(30-3)24-14-13-23-20/h5-15H,4H2,1-3H3,(H,23,26)(H,25,27)
InChIKeyICMKOMXRVQSRBV-UHFFFAOYSA-N
MW456.52 g/mol
LogP3.25
Rot. Bonds9

About 2-(4-ethylphenoxy)-N-[4-[(3-methoxypyrazin-2-yl)sulfamoyl]phenyl]propanamide

2-(4-ethylphenoxy)-N-[4-[(3-methoxypyrazin-2-yl)sulfamoyl]phenyl]propanamide (PubChem CID 54782995) has the molecular formula C22H24N4O5S and a molecular weight of 456.52 g/mol. Its IUPAC name is 2-(4-ethylphenoxy)-N-[4-[(3-methoxypyrazin-2-yl)sulfamoyl]phenyl]propanamide.

Molecular Properties

Compound Name2-(4-ethylphenoxy)-N-[4-[(3-methoxypyrazin-2-yl)sulfamoyl]phenyl]propanamide
PubChem CID54782995
Molecular FormulaC22H24N4O5S
Molecular Weight456.52 g/mol
Exact Mass456.15
IUPAC Name2-(4-ethylphenoxy)-N-[4-[(3-methoxypyrazin-2-yl)sulfamoyl]phenyl]propanamide
SMILESCCc1ccc(OC(C)C(=O)Nc2ccc(S(=O)(=O)Nc3nccnc3OC)cc2)cc1
InChIInChI=1S/C22H24N4O5S/c1-4-16-5-9-18(10-6-16)31-15(2)21(27)25-17-7-11-19(12-8-17)32(28,29)26-20-22(30-3)24-14-13-23-20/h5-15H,4H2,1-3H3,(H,23,26)(H,25,27)
InChIKeyICMKOMXRVQSRBV-UHFFFAOYSA-N
XLogP3.25
TPSA119.51 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds9
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500456.52
LogP ≤ 53.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

N-[4-[(3-methoxypyrazin-2-yl)sulfamoyl]phenyl]-2-(2-nitrophenoxy)propanamide
CID 54782638
(2S)-2-(4-ethylphenoxy)-N-[4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]phenyl]propanamide
CID 42426801
(2S)-2-(4-methoxyphenoxy)-N-[4-[(4-methoxyphenyl)sulfamoyl]phenyl]propanamide
CID 42063919
N-[[4-[(3-methoxypyrazin-2-yl)sulfamoyl]phenyl]carbamothioyl]-2-methylpropanamide
CID 54783157
N-(4-acetamidophenyl)-2-(4-ethylphenoxy)propanamide
CID 4953258
N-[4-[(3-methoxypyrazin-2-yl)sulfamoyl]phenyl]-2-(2-methylphenoxy)butanamide
CID 54782642
2-(3-ethylphenoxy)-N-[4-(pyridin-2-ylsulfamoyl)phenyl]propanamide
CID 53267157
2-phenoxy-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]propanamide
CID 3148025
N-[4-(butan-2-ylsulfamoyl)phenyl]-2-(4-methoxyphenoxy)propanamide
CID 17160189
1-[4-[(3-methoxypyrazin-2-yl)sulfamoyl]phenyl]-3-(4-methylphenyl)urea
CID 3424492
2-(4-fluorophenoxy)-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]propanamide
CID 2936144
(2S)-N-(4-ethylphenyl)-2-(4-propanoylphenoxy)propanamide
CID 8604722

Frequently Asked Questions

What is the IUPAC name of 2-(4-ethylphenoxy)-N-[4-[(3-methoxypyrazin-2-yl)sulfamoyl]phenyl]propanamide?
The IUPAC name of 2-(4-ethylphenoxy)-N-[4-[(3-methoxypyrazin-2-yl)sulfamoyl]phenyl]propanamide (CID 54782995) is 2-(4-ethylphenoxy)-N-[4-[(3-methoxypyrazin-2-yl)sulfamoyl]phenyl]propanamide.
What is the SMILES notation for 2-(4-ethylphenoxy)-N-[4-[(3-methoxypyrazin-2-yl)sulfamoyl]phenyl]propanamide?
The canonical SMILES for 2-(4-ethylphenoxy)-N-[4-[(3-methoxypyrazin-2-yl)sulfamoyl]phenyl]propanamide is CCc1ccc(OC(C)C(=O)Nc2ccc(S(=O)(=O)Nc3nccnc3OC)cc2)cc1.
What is the InChIKey of 2-(4-ethylphenoxy)-N-[4-[(3-methoxypyrazin-2-yl)sulfamoyl]phenyl]propanamide?
The InChIKey is ICMKOMXRVQSRBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N4O5S/c1-4-16-5-9-18(10-6-16)31-15(2)21(27)25-17-7-11-19(12-8-17)32(28,29)26-20-22(30-3)24-14-13-23-20/h5-15H,4H2,1-3H3,(H,23,26)(H,25,27).
What are the key properties of 2-(4-ethylphenoxy)-N-[4-[(3-methoxypyrazin-2-yl)sulfamoyl]phenyl]propanamide?
2-(4-ethylphenoxy)-N-[4-[(3-methoxypyrazin-2-yl)sulfamoyl]phenyl]propanamide has a molecular weight of 456.52 g/mol, XLogP of 3.25, 9 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-ethylphenoxy)-N-[4-[(3-methoxypyrazin-2-yl)sulfamoyl]phenyl]propanamide is sourced from PubChem (CID 54782995), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).