N-[2-chloro-4-[2-methoxyethyl(propyl)sulfamoyl]phenyl]acetamide

C14H21ClN2O4S — CID 3684242

IUPACN-[2-chloro-4-[2-methoxyethyl(propyl)sulfamoyl]phenyl]acetamide
SMILESCCCN(CCOC)S(=O)(=O)c1ccc(NC(C)=O)c(Cl)c1
InChIInChI=1S/C14H21ClN2O4S/c1-4-7-17(8-9-21-3)22(19,20)12-5-6-14(13(15)10-12)16-11(2)18/h5-6,10H,4,7-9H2,1-3H3,(H,16,18)
InChIKeyNHFSMLPFNGGHEH-UHFFFAOYSA-N
MW348.85 g/mol
LogP2.35
Rot. Bonds8

About N-[2-chloro-4-[2-methoxyethyl(propyl)sulfamoyl]phenyl]acetamide

N-[2-chloro-4-[2-methoxyethyl(propyl)sulfamoyl]phenyl]acetamide (PubChem CID 3684242) has the molecular formula C14H21ClN2O4S and a molecular weight of 348.85 g/mol. Its IUPAC name is N-[2-chloro-4-[2-methoxyethyl(propyl)sulfamoyl]phenyl]acetamide.

Molecular Properties

Compound NameN-[2-chloro-4-[2-methoxyethyl(propyl)sulfamoyl]phenyl]acetamide
PubChem CID3684242
Molecular FormulaC14H21ClN2O4S
Molecular Weight348.85 g/mol
Exact Mass348.09
IUPAC NameN-[2-chloro-4-[2-methoxyethyl(propyl)sulfamoyl]phenyl]acetamide
SMILESCCCN(CCOC)S(=O)(=O)c1ccc(NC(C)=O)c(Cl)c1
InChIInChI=1S/C14H21ClN2O4S/c1-4-7-17(8-9-21-3)22(19,20)12-5-6-14(13(15)10-12)16-11(2)18/h5-6,10H,4,7-9H2,1-3H3,(H,16,18)
InChIKeyNHFSMLPFNGGHEH-UHFFFAOYSA-N
XLogP2.35
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.85
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[4-[bis(2-cyanoethyl)sulfamoyl]-2-chlorophenyl]acetamide
CID 3504516
3-amino-4-chloro-N-(2-methoxyethyl)-N-(3-methoxypropyl)benzenesulfonamide
CID 61126076
N-(2,4-dichlorophenyl)-3-[2-methoxyethyl(methylsulfonyl)amino]propanamide
CID 113137781
4-[bis(2-methoxyethyl)sulfamoyl]-N-[4-[4-[[4-[bis(2-methoxyethyl)sulfamoyl]benzoyl]amino]-3-methoxyphenyl]-2-methoxyphenyl]benzamide
CID 4136881
2-[(3,4-dichlorophenyl)sulfonyl-(2-methoxyethyl)amino]-N-(2,3-dimethylphenyl)acetamide
CID 24678249
N-(4-acetamido-3-methylphenyl)-2-chloro-5-(diethylsulfamoyl)benzamide
CID 46550803
N-[2-chloro-4-(3-propoxypropylsulfamoyl)phenyl]acetamide
CID 3870575
N-[2-chloro-4-[methyl(pent-4-enyl)sulfamoyl]phenyl]acetamide
CID 71980428
N-[4-[2-chloroethyl(propyl)sulfamoyl]phenyl]acetamide
CID 63397159
methyl 4-[(4-acetamido-3-chlorophenyl)sulfonylamino]butanoate
CID 3849516
4-chloro-N-(2-methoxyethyl)-2,5-dimethyl-N-propylbenzenesulfonamide
CID 3868959
2-chloro-5-(diethylsulfamoyl)-N-(4-methoxybutyl)benzamide
CID 55716614

Frequently Asked Questions

What is the IUPAC name of N-[2-chloro-4-[2-methoxyethyl(propyl)sulfamoyl]phenyl]acetamide?
The IUPAC name of N-[2-chloro-4-[2-methoxyethyl(propyl)sulfamoyl]phenyl]acetamide (CID 3684242) is N-[2-chloro-4-[2-methoxyethyl(propyl)sulfamoyl]phenyl]acetamide.
What is the SMILES notation for N-[2-chloro-4-[2-methoxyethyl(propyl)sulfamoyl]phenyl]acetamide?
The canonical SMILES for N-[2-chloro-4-[2-methoxyethyl(propyl)sulfamoyl]phenyl]acetamide is CCCN(CCOC)S(=O)(=O)c1ccc(NC(C)=O)c(Cl)c1.
What is the InChIKey of N-[2-chloro-4-[2-methoxyethyl(propyl)sulfamoyl]phenyl]acetamide?
The InChIKey is NHFSMLPFNGGHEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21ClN2O4S/c1-4-7-17(8-9-21-3)22(19,20)12-5-6-14(13(15)10-12)16-11(2)18/h5-6,10H,4,7-9H2,1-3H3,(H,16,18).
What are the key properties of N-[2-chloro-4-[2-methoxyethyl(propyl)sulfamoyl]phenyl]acetamide?
N-[2-chloro-4-[2-methoxyethyl(propyl)sulfamoyl]phenyl]acetamide has a molecular weight of 348.85 g/mol, XLogP of 2.35, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-chloro-4-[2-methoxyethyl(propyl)sulfamoyl]phenyl]acetamide is sourced from PubChem (CID 3684242), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).