2-(4-chlorophenoxy)-N-[1-(3-sulfamoylphenyl)ethyl]acetamide

C16H17ClN2O4S — CID 51213474

IUPAC2-(4-chlorophenoxy)-N-[1-(3-sulfamoylphenyl)ethyl]acetamide
SMILESCC(NC(=O)COc1ccc(Cl)cc1)c1cccc(S(N)(=O)=O)c1
InChIInChI=1S/C16H17ClN2O4S/c1-11(12-3-2-4-15(9-12)24(18,21)22)19-16(20)10-23-14-7-5-13(17)6-8-14/h2-9,11H,10H2,1H3,(H,19,20)(H2,18,21,22)
InChIKeyUIANLZCHUXAFBK-UHFFFAOYSA-N
MW368.84 g/mol
LogP2.24
Rot. Bonds6

About 2-(4-chlorophenoxy)-N-[1-(3-sulfamoylphenyl)ethyl]acetamide

2-(4-chlorophenoxy)-N-[1-(3-sulfamoylphenyl)ethyl]acetamide (PubChem CID 51213474) has the molecular formula C16H17ClN2O4S and a molecular weight of 368.84 g/mol. Its IUPAC name is 2-(4-chlorophenoxy)-N-[1-(3-sulfamoylphenyl)ethyl]acetamide.

Molecular Properties

Compound Name2-(4-chlorophenoxy)-N-[1-(3-sulfamoylphenyl)ethyl]acetamide
PubChem CID51213474
Molecular FormulaC16H17ClN2O4S
Molecular Weight368.84 g/mol
Exact Mass368.06
IUPAC Name2-(4-chlorophenoxy)-N-[1-(3-sulfamoylphenyl)ethyl]acetamide
SMILESCC(NC(=O)COc1ccc(Cl)cc1)c1cccc(S(N)(=O)=O)c1
InChIInChI=1S/C16H17ClN2O4S/c1-11(12-3-2-4-15(9-12)24(18,21)22)19-16(20)10-23-14-7-5-13(17)6-8-14/h2-9,11H,10H2,1H3,(H,19,20)(H2,18,21,22)
InChIKeyUIANLZCHUXAFBK-UHFFFAOYSA-N
XLogP2.24
TPSA98.49 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.84
LogP ≤ 52.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(3-chloro-4-fluorophenoxy)-N-[1-(3-sulfamoylphenyl)ethyl]acetamide
CID 134002717
2-[(4-chlorophenyl)methylsulfanyl]-N-[1-(3-sulfamoylphenyl)ethyl]acetamide
CID 51213542
2-propoxy-N-[1-(3-sulfamoylphenyl)ethyl]acetamide
CID 51102309
N-[3-[1-[[2-(4-chlorophenoxy)acetyl]amino]ethyl]phenyl]benzamide
CID 46456558
4-oxo-4-(4-propoxyphenyl)-N-[1-(3-sulfamoylphenyl)ethyl]butanamide
CID 55396046
N-[(1R)-1-(3-chlorophenyl)ethyl]-2-(4-cyanophenoxy)acetamide
CID 7503511
ethyl 4-[2-[[(1S)-1-(3-chlorophenyl)ethyl]amino]-2-oxoethoxy]benzoate
CID 7471705
2-(4-benzoylphenoxy)-N-[(1S)-1-(3-chlorophenyl)ethyl]acetamide
CID 7717900
N-[(1S)-1-(3-chlorophenyl)ethyl]-2-(4-propanoylphenoxy)acetamide
CID 7788222
3,5-dichloro-N-[1-(3-sulfamoylphenyl)ethyl]benzamide
CID 51213469
3-methyl-N-[1-(3-sulfamoylphenyl)ethyl]pentanamide
CID 114876353
2-[4-[benzenesulfonyl(ethyl)amino]phenoxy]-N-[(1R)-1-(4-chlorophenyl)ethyl]acetamide
CID 92649203

Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenoxy)-N-[1-(3-sulfamoylphenyl)ethyl]acetamide?
The IUPAC name of 2-(4-chlorophenoxy)-N-[1-(3-sulfamoylphenyl)ethyl]acetamide (CID 51213474) is 2-(4-chlorophenoxy)-N-[1-(3-sulfamoylphenyl)ethyl]acetamide.
What is the SMILES notation for 2-(4-chlorophenoxy)-N-[1-(3-sulfamoylphenyl)ethyl]acetamide?
The canonical SMILES for 2-(4-chlorophenoxy)-N-[1-(3-sulfamoylphenyl)ethyl]acetamide is CC(NC(=O)COc1ccc(Cl)cc1)c1cccc(S(N)(=O)=O)c1.
What is the InChIKey of 2-(4-chlorophenoxy)-N-[1-(3-sulfamoylphenyl)ethyl]acetamide?
The InChIKey is UIANLZCHUXAFBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17ClN2O4S/c1-11(12-3-2-4-15(9-12)24(18,21)22)19-16(20)10-23-14-7-5-13(17)6-8-14/h2-9,11H,10H2,1H3,(H,19,20)(H2,18,21,22).
What are the key properties of 2-(4-chlorophenoxy)-N-[1-(3-sulfamoylphenyl)ethyl]acetamide?
2-(4-chlorophenoxy)-N-[1-(3-sulfamoylphenyl)ethyl]acetamide has a molecular weight of 368.84 g/mol, XLogP of 2.24, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenoxy)-N-[1-(3-sulfamoylphenyl)ethyl]acetamide is sourced from PubChem (CID 51213474), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).