2-(3-ethylphenoxy)-N-[4-[[(2R)-1-methoxypropan-2-yl]sulfamoyl]phenyl]acetamide

C20H26N2O5S — CID 51549053

IUPAC2-(3-ethylphenoxy)-N-[4-[[(2R)-1-methoxypropan-2-yl]sulfamoyl]phenyl]acetamide
SMILESCCc1cccc(OCC(=O)Nc2ccc(S(=O)(=O)N[C@H](C)COC)cc2)c1
InChIInChI=1S/C20H26N2O5S/c1-4-16-6-5-7-18(12-16)27-14-20(23)21-17-8-10-19(11-9-17)28(24,25)22-15(2)13-26-3/h5-12,15,22H,4,13-14H2,1-3H3,(H,21,23)/t15-/m1/s1
InChIKeyGKEGKNGQCNGYFS-OAHLLOKOSA-N
MW406.50 g/mol
LogP2.58
Rot. Bonds10

About 2-(3-ethylphenoxy)-N-[4-[[(2R)-1-methoxypropan-2-yl]sulfamoyl]phenyl]acetamide

2-(3-ethylphenoxy)-N-[4-[[(2R)-1-methoxypropan-2-yl]sulfamoyl]phenyl]acetamide (PubChem CID 51549053) has the molecular formula C20H26N2O5S and a molecular weight of 406.50 g/mol. Its IUPAC name is 2-(3-ethylphenoxy)-N-[4-[[(2R)-1-methoxypropan-2-yl]sulfamoyl]phenyl]acetamide.

Molecular Properties

Compound Name2-(3-ethylphenoxy)-N-[4-[[(2R)-1-methoxypropan-2-yl]sulfamoyl]phenyl]acetamide
PubChem CID51549053
Molecular FormulaC20H26N2O5S
Molecular Weight406.50 g/mol
Exact Mass406.16
IUPAC Name2-(3-ethylphenoxy)-N-[4-[[(2R)-1-methoxypropan-2-yl]sulfamoyl]phenyl]acetamide
SMILESCCc1cccc(OCC(=O)Nc2ccc(S(=O)(=O)N[C@H](C)COC)cc2)c1
InChIInChI=1S/C20H26N2O5S/c1-4-16-6-5-7-18(12-16)27-14-20(23)21-17-8-10-19(11-9-17)28(24,25)22-15(2)13-26-3/h5-12,15,22H,4,13-14H2,1-3H3,(H,21,23)/t15-/m1/s1
InChIKeyGKEGKNGQCNGYFS-OAHLLOKOSA-N
XLogP2.58
TPSA93.73 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500406.50
LogP ≤ 52.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[4-(1-methoxypropan-2-ylsulfamoyl)phenyl]-4-phenoxybutanamide
CID 43007962
2-(3-ethylphenoxy)-N-(4-hydroxyphenyl)acetamide
CID 51186827
2-[4-[[(2R)-butan-2-yl]sulfamoyl]phenoxy]-N-(3-methoxyphenyl)acetamide
CID 126201924
2-methylpropyl 4-[[2-(3-ethylphenoxy)acetyl]amino]benzoate
CID 19177259
N-[4-[[(2S)-1-methoxypropan-2-yl]sulfamoyl]phenyl]acetamide
CID 670303
N-[4-(1-methoxypropan-2-ylsulfamoyl)phenyl]-2-methylbutanamide
CID 51331716
2-(3-ethylphenoxy)-N-(4-nitrophenyl)acetamide
CID 2792700
4-ethyl-N-(1-methoxypropan-2-yl)benzenesulfonamide
CID 51183649
2-[4-[[(2R)-butan-2-yl]sulfamoyl]phenoxy]-N-(4-sulfamoylphenyl)acetamide
CID 126212081
N-(4-bromophenyl)-2-[4-[[(2R)-butan-2-yl]sulfamoyl]phenoxy]acetamide
CID 1287541
N-[4-(1-methoxypropan-2-ylsulfamoyl)phenyl]-3-phenylbutanamide
CID 43007936
dimethyl 5-[[2-(3-ethylphenoxy)acetyl]amino]benzene-1,3-dicarboxylate
CID 2711605

Frequently Asked Questions

What is the IUPAC name of 2-(3-ethylphenoxy)-N-[4-[[(2R)-1-methoxypropan-2-yl]sulfamoyl]phenyl]acetamide?
The IUPAC name of 2-(3-ethylphenoxy)-N-[4-[[(2R)-1-methoxypropan-2-yl]sulfamoyl]phenyl]acetamide (CID 51549053) is 2-(3-ethylphenoxy)-N-[4-[[(2R)-1-methoxypropan-2-yl]sulfamoyl]phenyl]acetamide.
What is the SMILES notation for 2-(3-ethylphenoxy)-N-[4-[[(2R)-1-methoxypropan-2-yl]sulfamoyl]phenyl]acetamide?
The canonical SMILES for 2-(3-ethylphenoxy)-N-[4-[[(2R)-1-methoxypropan-2-yl]sulfamoyl]phenyl]acetamide is CCc1cccc(OCC(=O)Nc2ccc(S(=O)(=O)N[C@H](C)COC)cc2)c1.
What is the InChIKey of 2-(3-ethylphenoxy)-N-[4-[[(2R)-1-methoxypropan-2-yl]sulfamoyl]phenyl]acetamide?
The InChIKey is GKEGKNGQCNGYFS-OAHLLOKOSA-N. The full InChI is InChI=1S/C20H26N2O5S/c1-4-16-6-5-7-18(12-16)27-14-20(23)21-17-8-10-19(11-9-17)28(24,25)22-15(2)13-26-3/h5-12,15,22H,4,13-14H2,1-3H3,(H,21,23)/t15-/m1/s1.
What are the key properties of 2-(3-ethylphenoxy)-N-[4-[[(2R)-1-methoxypropan-2-yl]sulfamoyl]phenyl]acetamide?
2-(3-ethylphenoxy)-N-[4-[[(2R)-1-methoxypropan-2-yl]sulfamoyl]phenyl]acetamide has a molecular weight of 406.50 g/mol, XLogP of 2.58, 10 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-ethylphenoxy)-N-[4-[[(2R)-1-methoxypropan-2-yl]sulfamoyl]phenyl]acetamide is sourced from PubChem (CID 51549053), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).