N-[2-methoxy-5-[1-(2,4,5-trimethylphenyl)ethylsulfamoyl]phenyl]acetamide

C20H26N2O4S — CID 43906499

IUPACN-[2-methoxy-5-[1-(2,4,5-trimethylphenyl)ethylsulfamoyl]phenyl]acetamide
SMILESCOc1ccc(S(=O)(=O)NC(C)c2cc(C)c(C)cc2C)cc1NC(C)=O
InChIInChI=1S/C20H26N2O4S/c1-12-9-14(3)18(10-13(12)2)15(4)22-27(24,25)17-7-8-20(26-6)19(11-17)21-16(5)23/h7-11,15,22H,1-6H3,(H,21,23)
InChIKeyIYELDCWJLJWXLE-UHFFFAOYSA-N
MW390.51 g/mol
LogP3.62
Rot. Bonds6

About N-[2-methoxy-5-[1-(2,4,5-trimethylphenyl)ethylsulfamoyl]phenyl]acetamide

N-[2-methoxy-5-[1-(2,4,5-trimethylphenyl)ethylsulfamoyl]phenyl]acetamide (PubChem CID 43906499) has the molecular formula C20H26N2O4S and a molecular weight of 390.51 g/mol. Its IUPAC name is N-[2-methoxy-5-[1-(2,4,5-trimethylphenyl)ethylsulfamoyl]phenyl]acetamide.

Molecular Properties

Compound NameN-[2-methoxy-5-[1-(2,4,5-trimethylphenyl)ethylsulfamoyl]phenyl]acetamide
PubChem CID43906499
Molecular FormulaC20H26N2O4S
Molecular Weight390.51 g/mol
Exact Mass390.16
IUPAC NameN-[2-methoxy-5-[1-(2,4,5-trimethylphenyl)ethylsulfamoyl]phenyl]acetamide
SMILESCOc1ccc(S(=O)(=O)NC(C)c2cc(C)c(C)cc2C)cc1NC(C)=O
InChIInChI=1S/C20H26N2O4S/c1-12-9-14(3)18(10-13(12)2)15(4)22-27(24,25)17-7-8-20(26-6)19(11-17)21-16(5)23/h7-11,15,22H,1-6H3,(H,21,23)
InChIKeyIYELDCWJLJWXLE-UHFFFAOYSA-N
XLogP3.62
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.51
LogP ≤ 53.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3,4-dimethoxy-N-[1-(2,4,5-trimethylphenyl)ethyl]benzenesulfonamide
CID 133217933
N-[5-[[(1S)-1-(3,4-dimethoxyphenyl)ethyl]sulfamoyl]-2-methoxyphenyl]acetamide
CID 28557971
N-[5-[[(1S)-1-(2,4-dichlorophenyl)ethyl]sulfamoyl]-2-methoxyphenyl]acetamide
CID 8797504
N-[5-[[(2S)-butan-2-yl]sulfamoyl]-2-methoxyphenyl]acetamide
CID 8777670
N-[5-[1-(4-bromophenyl)ethylsulfamoyl]-2-methoxyphenyl]acetamide
CID 43874029
2-methoxy-N-propan-2-yl-5-[1-(2,4,5-trimethylphenyl)ethylsulfamoyl]benzamide
CID 133220057
N-[4-[1-(2,4,5-trimethylphenyl)ethylsulfamoyl]phenyl]acetamide
CID 133217936
N-[5-[[(1R)-1-(furan-2-yl)ethyl]sulfamoyl]-2-methoxyphenyl]acetamide
CID 8817620
N-[5-[[(2R)-1-aminopropan-2-yl]sulfamoyl]-2-methoxyphenyl]acetamide
CID 104873300
N-[2-methoxy-5-[[(1S)-2-methyl-1-(4-propan-2-ylphenyl)propyl]sulfamoyl]phenyl]acetamide
CID 9190712
(2S)-2-[(4-methoxy-3-methylphenyl)sulfonylamino]-N-[(1S)-1-(2,4,5-trimethylphenyl)ethyl]propanamide
CID 30404005
N-[5-[[(2S)-1-hydroxybutan-2-yl]sulfamoyl]-2-methoxyphenyl]acetamide
CID 104981838

Frequently Asked Questions

What is the IUPAC name of N-[2-methoxy-5-[1-(2,4,5-trimethylphenyl)ethylsulfamoyl]phenyl]acetamide?
The IUPAC name of N-[2-methoxy-5-[1-(2,4,5-trimethylphenyl)ethylsulfamoyl]phenyl]acetamide (CID 43906499) is N-[2-methoxy-5-[1-(2,4,5-trimethylphenyl)ethylsulfamoyl]phenyl]acetamide.
What is the SMILES notation for N-[2-methoxy-5-[1-(2,4,5-trimethylphenyl)ethylsulfamoyl]phenyl]acetamide?
The canonical SMILES for N-[2-methoxy-5-[1-(2,4,5-trimethylphenyl)ethylsulfamoyl]phenyl]acetamide is COc1ccc(S(=O)(=O)NC(C)c2cc(C)c(C)cc2C)cc1NC(C)=O.
What is the InChIKey of N-[2-methoxy-5-[1-(2,4,5-trimethylphenyl)ethylsulfamoyl]phenyl]acetamide?
The InChIKey is IYELDCWJLJWXLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N2O4S/c1-12-9-14(3)18(10-13(12)2)15(4)22-27(24,25)17-7-8-20(26-6)19(11-17)21-16(5)23/h7-11,15,22H,1-6H3,(H,21,23).
What are the key properties of N-[2-methoxy-5-[1-(2,4,5-trimethylphenyl)ethylsulfamoyl]phenyl]acetamide?
N-[2-methoxy-5-[1-(2,4,5-trimethylphenyl)ethylsulfamoyl]phenyl]acetamide has a molecular weight of 390.51 g/mol, XLogP of 3.62, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-methoxy-5-[1-(2,4,5-trimethylphenyl)ethylsulfamoyl]phenyl]acetamide is sourced from PubChem (CID 43906499), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).